Exact Mass: 206.1782892

Exact Mass Matches: 206.1782892

Found 500 metabolites which its exact mass value is equals to given mass value 206.1782892, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

tolkan

N-(4-(1-methylethyl)phenyl)-N,N-dimethylurea

C12H18N2O (206.1419058)


CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8628; ORIGINAL_PRECURSOR_SCAN_NO 8626 CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8663; ORIGINAL_PRECURSOR_SCAN_NO 8661 CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8683; ORIGINAL_PRECURSOR_SCAN_NO 8681 CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8581; ORIGINAL_PRECURSOR_SCAN_NO 8579 CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8616; ORIGINAL_PRECURSOR_SCAN_NO 8615 CONFIDENCE standard compound; INTERNAL_ID 33; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8680; ORIGINAL_PRECURSOR_SCAN_NO 8678 EAWAG_UCHEM_ID 286; CONFIDENCE standard compound CONFIDENCE standard compound; EAWAG_UCHEM_ID 286 CONFIDENCE standard compound; INTERNAL_ID 3518 CONFIDENCE standard compound; INTERNAL_ID 4005 CONFIDENCE standard compound; INTERNAL_ID 8381 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

4-(1,1,3,3-Tetramethylbutyl)-phenol

alpha-(p-(1,1,3,3-Tetramethylbutyl)phenyl)-omega-hydroxypoly(oxyethylene)

C14H22O (206.1670562)


4-(1,1,3,3-Tetramethylbutyl)-phenol is manufactured via a catalytic reaction of phenol with diisobutylene. It is a member of the class of compounds known as phenylpropanes. Phenylpropanes are organic compounds that contain a phenylpropane moiety. 4-(1,1,3,3-Tetramethylbutyl)-phenol can be found primarily in feces and urine. Within the cell, 4-(1,1,3,3-Tetramethylbutyl)-phenol is primarily located in the membrane (predicted from logP). It is a non-carcinogenic (not listed by IARC) potentially toxic compound. 4-(1,1,3,3-Tetramethylbutyl)-phenol is biodegradable, and in the surface layer of natural waters, 30\\\% of OP can be degraded within one day. 4-(1,1,3,3-Tetramethylbutyl)-phenol is acutely very toxic to aquatic organisms and may cause long-term adverse effects in the aquatic environment. It is not acutely toxic to human health, but it is slightly irritating to the skin and highly irritating to the eyes. It is not genotoxic, but it may cause depigmentation of the skin. 4-(1,1,3,3-Tetramethylbutyl)-phenol is used as a food additive (EAFUS: Everything Added to Food in the United States). CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5475; ORIGINAL_PRECURSOR_SCAN_NO 5474 CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5507; ORIGINAL_PRECURSOR_SCAN_NO 5506 CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5472; ORIGINAL_PRECURSOR_SCAN_NO 5470 CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5015; ORIGINAL_PRECURSOR_SCAN_NO 5012 CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5452; ORIGINAL_PRECURSOR_SCAN_NO 5448 CONFIDENCE standard compound; INTERNAL_ID 939; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5519; ORIGINAL_PRECURSOR_SCAN_NO 5518 D013501 - Surface-Active Agents It is used as a food additive . 4-tert-Octylphenol, a endocrine-disrupting chemical, is an estrogenic agent. 4-tert-Octylphenol induces apoptosis in neuronal progenitor cells in offspring mouse brain. 4-tert-Octylphenol reduces bromodeoxyuridine (BrdU), mitotic marker Ki67, and phospho-histone H3 (p-Histone-H3), resulting in a reduction of neuronal progenitor proliferation. 4-tert-Octylphenol disrupts brain development and behavior in mice[1].

   

Monoethylglycinexylidide

N-(2,6-Dimethylphenyl)-2-(ethylamino)acetamide

C12H18N2O (206.1419058)


Monoethylglycinexylidide, also known as norlidocaine or MEGX, belongs to the class of organic compounds known as alpha-amino acid amides. These are amide derivatives of alpha-amino acids. Monoethylglycinexylidide is a very strong basic compound (based on its pKa). Monoethylglycinexylidide is a metabolite of lidocaine, also known as lignocaine. Lidocaine (trade name: Xylocaine) is a common local anesthetic and antiarrhythmic drug. Lidocaine is used topically to relieve itching, burning, and pain from skin inflammations, is injected as a dental anesthetic, or is injected as a local anesthetic for minor surgery (Wikipedia). Monoethylglycinexylidide and formaldehyde can be biosynthesized from lidocaine via the enzymes cytochrome P450 1A2 and cytochrome P450 3A4. CONFIDENCE Transformation product with Reference Standard (Level 1); INTERNAL_ID 802 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3471 CONFIDENCE standard compound; INTERNAL_ID 2113

   

Ibuprofen

2-[4-(2-methylpropyl)phenyl]propanoic acid

C13H18O2 (206.1306728)


Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID) widely marketed under various trademarks including Act-3, Advil, Brufen, Motrin, Nuprin, and Nurofen. It is used for relief of symptoms of arthritis, primary dysmenorrhoea, and fever; Ibuprofen is an NSAID which is believed to work through inhibition of cyclooxygenase (COX), thus inhibiting prostaglandin synthesis. There are at least 2 variations of cyclooxygenase (COX-1 and COX-2), ibuprofen inhibits both COX-1 and COX-2. It appears that its analgesic, antipyretic, and anti-inflammatory activity are achieved principally through COX-2 inhibition; whereas COX-1 inhibition is responsible for its unwanted effects on platelet aggregation and the GI mucosa. As with other NSAIDs, ibuprofen inhibits platelet aggregation, but is not used therapeutically for this action since it is a minor and reversible effect. -- Wikipedia [HMDB] Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID) widely marketed under various trademarks including Act-3, Advil, Brufen, Motrin, Nuprin, and Nurofen. It is used for relief of symptoms of arthritis, primary dysmenorrhoea, and fever; Ibuprofen is an NSAID which is believed to work through inhibition of cyclooxygenase (COX), thus inhibiting prostaglandin synthesis. There are at least 2 variations of cyclooxygenase (COX-1 and COX-2), ibuprofen inhibits both COX-1 and COX-2. It appears that its analgesic, antipyretic, and anti-inflammatory activity are achieved principally through COX-2 inhibition; whereas COX-1 inhibition is responsible for its unwanted effects on platelet aggregation and the GI mucosa. As with other NSAIDs, ibuprofen inhibits platelet aggregation, but is not used therapeutically for this action since it is a minor and reversible effect. -- Wikipedia. M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain > M02AA - Antiinflammatory preparations, non-steroids for topical use M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AE - Propionic acid derivatives G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CC - Antiinflammatory products for vaginal administration D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials, DrugBank R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor C - Cardiovascular system > C01 - Cardiac therapy D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

4-Octylphenol

1-(p-Hydroxyphenyl)octane

C14H22O (206.1670562)


CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4924; ORIGINAL_PRECURSOR_SCAN_NO 4922 CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4929; ORIGINAL_PRECURSOR_SCAN_NO 4926 CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5507; ORIGINAL_PRECURSOR_SCAN_NO 5506 CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5486; ORIGINAL_PRECURSOR_SCAN_NO 5483 CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4941; ORIGINAL_PRECURSOR_SCAN_NO 4939 CONFIDENCE standard compound; INTERNAL_ID 938; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5519; ORIGINAL_PRECURSOR_SCAN_NO 5518 D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens

   

Plastoquinol-1

2,3-dimethyl-5-(3-methylbut-2-enyl)-benzene-1,4-diol

C13H18O2 (206.1306728)


   

Oxotremorine

1-[4-(pyrrolidin-1-yl)but-2-yn-1-yl]pyrrolidin-2-one

C12H18N2O (206.1419058)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018679 - Cholinergic Agonists

   

alpha-Irone

4-(2,5,6,6-Tetramethyl-2-cyclohexen-1-yl)-3-buten-2-one, 9ci

C14H22O (206.1670562)


D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids alpha-Irone is a flavouring ingredien Flavouring ingredient

   

(+)-trans-alpha-Irone

(+)-trans-alpha-Irone

C14H22O (206.1670562)


   

2-(3-Pentylphenyl)acetic acid

2-(3-Pentylphenyl)acetic acid

C13H18O2 (206.1306728)


C78273 - Agent Affecting Respiratory System

   

DICYCLOHEXYLCARBODIIMIDE

DICYCLOHEXYLCARBODIIMIDE

C13H22N2 (206.1782892)


   

Amyl phenylacetate

Acetic acid, phenyl-, pentyl ester (8ci)

C13H18O2 (206.1306728)


Amyl phenylacetate is a flavouring ingredient. Flavouring ingredient

   

3-Acetoxy-3-methyl-1-phenylbutane

Benzenepropanol, alpha,alpha-dimethyl-, 1-acetate

C13H18O2 (206.1306728)


3-Acetoxy-3-methyl-1-phenylbutane is a flavouring ingredien Flavouring ingredient

   

2-Phenylethyl 3-methylbutanoate

Butanoic acid, 3-methyl-, 2-phenylethyl ester

C13H18O2 (206.1306728)


2-Phenylethyl 3-methylbutanoate is found in alcoholic beverages. 2-Phenylethyl 3-methylbutanoate is a food flavour. 2-Phenylethyl 3-methylbutanoate is found in mint oils, alcoholic beverages and other source Food flavour. Found in mint oils, alcoholic beverages and other sources

   

10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al

8,8a-dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carbaldehyde

C13H18O2 (206.1306728)


10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al is found in green vegetables. 10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al is a constituent of Petasites japonicus ssp. giganteus (Japanese butterbur). Constituent of Petasites japonicus sspecies giganteus (Japanese butterbur). 10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al is found in green vegetables.

   

Hexyl benzoate

2-Ethylhexyl-4-hydroxybenzoate

C13H18O2 (206.1306728)


Present in fruits of apricot, lingonberry, cowberry, feijoa, peach, sapodilla and other fruitsand is) also present in Parmesan cheese, butter and black tea. Flavouring ingredient. Hexyl benzoate is found in tea, milk and milk products, and fruits. Hexyl benzoate is found in fruits. Hexyl benzoate is present in fruits of apricot, lingonberry, cowberry, feijoa, peach, sapodilla and other fruits. Also present in Parmesan cheese, butter and black tea. Hexyl benzoate is a flavouring ingredient.

   

Eremopetasinorone A

2-acetyl-3a,4-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-inden-5-one

C13H18O2 (206.1306728)


Eremopetasinorone B is found in green vegetables. Eremopetasinorone B is a constituent of Petasites japonicus (sweet coltsfoot)

   

Etrogol

2-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}ethan-1-ol

C13H18O2 (206.1306728)


Isolated from the roots of Citrus subspecies Etrogol is found in sweet orange and citrus. Etrogol is found in citrus. Etrogol is isolated from the roots of Citrus species.

   

Agrocybenine

1,2,3,5-tetrahydro-2,2,5,5,7-Pentamethyl-6H-pyrrolo[2,3-b]pyridin-6-one, 9ci

C12H18N2O (206.1419058)


Agrocybenine is found in mushrooms. Agrocybenine is an alkaloid from the edible Korean mushroom yangimatusutake (Agrocybe cylindracea). Alkaloid from the edible Korean mushroom yangimatusutake (Agrocybe cylindracea). Agrocybenine is found in mushrooms.

   

Benzyl hexanoate

Hexanoic acid, phenylmethyl ester

C13H18O2 (206.1306728)


Benzyl hexanoate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

2,4-Di-tert-butylphenol

1-Hydroxy-2,4-di-tert-butylbenzene

C14H22O (206.1670562)


2,4-Di-tert-butylphenol, also known as 2,4-DTBP, belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety. 2,4-Di-tert-butylphenol is an extremely weak basic (essentially neutral) compound (based on its pKa). 2,4-Di-tert-butylphenol is a synthetic phenolic antioxidant (SPA). SPAs are a family of chemicals used widely in foods, polymers, and cosmetics as radical trapping agents to slow down degradation due to oxidation. Given their widespread use, human exposure is unavoidable and there is public concern regarding environmental contamination by these chemicals. 2,4-Di-tert-butylphenol was detected at extremely high concentrations in human urine (PMID: 31265952). 2,4-Di-tert-butylphenol is an endogenous metabolite. 2,4-Di-tert-butylphenol is an endogenous metabolite.

   

delta-Methylionone

(3E)-3-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one

C14H22O (206.1670562)


delta-Methylionone is a flavouring ingredien Flavouring ingredient

   

3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one

(3E)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one

C14H22O (206.1670562)


(±)-(E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one is a flavouring ingredien D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids It is used as a food additive .

   

Methyl-delta-ionone

(1E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one

C14H22O (206.1670562)


Methyl-delta-ionone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

(E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one

(3E)-6-methyl-6-(5-methylfuran-2-yl)hept-3-en-2-one

C13H18O2 (206.1306728)


Constituent of lavender, prunes, green and black tea and spinach leaves. (E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one is found in many foods, some of which are herbs and spices, fruits, green vegetables, and tea. (E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one is found in fruits. (E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one is a constituent of lavender, prunes, green and black tea and spinach leaves.

   

2-Phenylpropyl butyrate

Butanoic acid, 2-phenylpropyl ester

C13H18O2 (206.1306728)


2-Phenylpropyl butyrate is a flavouring ingredien Flavouring ingredient

   

2-Phenylpropyl isobutyrate

2-Phenylpropyl 2-methylpropanoic acid

C13H18O2 (206.1306728)


2-Phenylpropyl isobutyrate is a flavouring ingredien Flavouring ingredient

   

3-Phenylpropyl 2-methylpropanoate

Propanoic acid, 2-methyl-, 3-phenylpropyl ester

C13H18O2 (206.1306728)


3-Phenylpropyl 2-methylpropanoate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

3-Methylbutyl phenylacetate

Benzeneacetic acid, 3-methylbutyl ester

C13H18O2 (206.1306728)


3-Methylbutyl phenylacetate is found in peppermint. 3-Methylbutyl phenylacetate is a flavouring ingredien Flavouring ingredient. 3-Methylbutyl phenylacetate is found in peppermint.

   

2-Phenylethyl pentanoate

Pentanoic acid, 2-phenylethyl ester

C13H18O2 (206.1306728)


2-Phenylethyl pentanoate is found in peppermint. 2-Phenylethyl pentanoate is a flavouring ingredien Flavouring ingredient. 2-Phenylethyl pentanoate is found in peppermint.

   

xi-8,9-Dehydrotheaspirone

2,6,10,10-tetramethyl-1-oxaspiro[4.5]deca-2,6-dien-8-one

C13H18O2 (206.1306728)


Volatile flavour constituent of white-fleshed nectarines, oranges and Riesling wine. xi-8,9-Dehydrotheaspirone is found in alcoholic beverages, citrus, and fruits. The more odiferous enantiomer of the compound 8,9-Dehydrotheaspirone, a flavour and perfumery ingredient [CCD].

   

1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one

(1E)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one

C14H22O (206.1670562)


1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one is a flavouring ingredient. Flavouring ingredient

   

Etaspirene

6-ethyl-2,10,10-trimethyl-1-oxaspiro[4.5]deca-3,6-diene

C14H22O (206.1670562)


Etaspirene is a fragrance ingredient with a blackcurrant-like arom Fragrance ingredient with a blackcurrant-like aroma

   

10-Isopropyl-2,7-dimethyl-1-oxaspiro[4.5]deca-3,6-diene

2,7-Dimethyl-10-(1-methylethyl)-1-oxaspiro[4.5]deca-3,6-diene, 9ci

C14H22O (206.1670562)


10-Isopropyl-2,7-dimethyl-1-oxaspiro[4.5]deca-3,6-diene is a fragrance ingredient with a blackcurrant-like arom Fragrance ingredient with a blackcurrant-like aroma

   

2,4,6-Trimethyl-4-phenyl-1,3-dioxane

2,4,6-trimethyl-4-phenyl-1,3-dioxane

C13H18O2 (206.1306728)


2,4,6-Trimethyl-4-phenyl-1,3-dioxane is a fragrance ingredient with a grapefruit-like arom Fragrance ingredient with a grapefruit-like aroma

   

Methyl 4-tert-butylphenylacetate

Benzeneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester

C13H18O2 (206.1306728)


Methyl 4-tert-butylphenylacetate is a flavouring ingredient with a roasted, chocolate-like flavour. Methyl 4-tert-butylphenylacetate is used in oral care product Flavouring ingredient with a roasted, chocolate-like flavour. It is used in oral care products Methyl p-tert-butylphenylacetate is an endogenous metabolite.

   

1-Phenylpropyl butyrate

Butyric acid, alpha-ethylbenzyl ester

C13H18O2 (206.1306728)


1-Phenylpropyl butyrate is a flavouring ingredient. Flavouring ingredient

   

alpha-Methylphenethyl butyrate

alpha-Methylphenethyl butyric acid

C13H18O2 (206.1306728)


alpha-Methylphenethyl butyrate is a flavouring ingredient. Flavouring ingredient

   

Ethyl (±)-2-ethyl-3-phenylpropanoate

Benzenepropanoic acid, alpha-ethyl-, ethyl ester

C13H18O2 (206.1306728)


Ethyl (±)-2-ethyl-3-phenylpropanoate is a flavouring ingredient. Flavouring ingredient

   

1-Methyl-1-phenylethyl isobutyrate

Propanoic acid, 2-methyl-, 1-methyl-1-phenylethyl ester

C13H18O2 (206.1306728)


1-Methyl-1-phenylethyl isobutyrate is a flavouring ingredient. Flavouring ingredient

   

2-Phenylethyl 2-methylbutanoate

Butanoic acid, 2-methyl-, 2-phenylethyl ester

C13H18O2 (206.1306728)


2-Phenylethyl 2-methylbutanoate is found in alcoholic beverages. 2-Phenylethyl 2-methylbutanoate is isolated from Mentha cardiaca, Alpinia officinarum (lesser galangal) and cider. 2-Phenylethyl 2-methylbutanoate is a food flavouring ingredient. Isolated from Mentha cardiaca, Alpinia officinarum (lesser galangal) and cider. Food flavouring ingredient. 2-Phenylethyl 2-methylbutanoate is found in alcoholic beverages and herbs and spices.

   

1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one

(1E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one

C14H22O (206.1670562)


1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one is a flavouring ingredient. Flavouring ingredient

   

1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane

1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane

C15H26 (206.2034396)


1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes.

   

(Z)-alpha-Irone

(3Z)-4-[(1R)-2,5,6,6-tetramethylcyclohex-2-en-1-yl]but-3-en-2-one

C14H22O (206.1670562)


(Z)-alpha-Irone belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.

   

2-(3-Pentylphenyl)acetic acid

2-(3-Pentylphenyl)acetic acid

C13H18O2 (206.1306728)


C78273 - Agent Affecting Respiratory System

   

N-Hydroxy-N'-(4-butyl-2-methylphenyl)formamidine

N-(4-butyl-2-methylphenyl)-N-hydroxymethanimidamide

C12H18N2O (206.1419058)


   

4-(1,1-Dimethylhexyl)phenol

4-(2-methylheptan-2-yl)phenol

C14H22O (206.1670562)


   

4-(2,5,6,6-Tetramethylcyclohexen-1-yl)but-3-en-2-one

4-(2,5,6,6-tetramethylcyclohex-1-en-1-yl)but-3-en-2-one

C14H22O (206.1670562)


   

Dicyclohexylcarbodiimide

N,N-methanetetraylbiscyclohexaamine

C13H22N2 (206.1782892)


   

(6E,10E)-2,6,10-Trimethyldodeca-2,6,10-triene

(6E,10E)-2,6,10-Trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)


   

Octylphenol

phenol, o-octyl-

C14H22O (206.1670562)


   

2-(Ethylamino)-N-methyl-N-(p-tolyl)acetamide

2-(ethylamino)-N-methyl-N-(4-methylphenyl)acetamide

C12H18N2O (206.1419058)


   

Phenol, 2-(1,1,3,3-tetramethylbutyl)-

Phenol, 2-(1,1,3,3-tetramethylbutyl)-

C14H22O (206.1670562)


   

3,7,11-Trimethyldodeca-1,6,10-triene

3,7,11-trimethyldodeca-1,6,10-triene

C15H26 (206.2034396)


   

Cedranoxide

(1S,4R,7S,11R,13R)-4,11-dimethyl-5-oxatetracyclo[5.4.2.0¹,⁸.0⁴,¹³]tridecane

C14H22O (206.1670562)


Cedranoxide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Cedranoxide can be found in pot marjoram, which makes cedranoxide a potential biomarker for the consumption of this food product.

   

beta-Muurolene

(4S,4aS,8aR)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,5,8,8a-octahydronaphthalene

C15H26 (206.2034396)


Beta-muurolene can be found in cloves, which makes beta-muurolene a potential biomarker for the consumption of this food product.

   

3-Oxo-beta-damascone

4-[(2E)-but-2-enoyl]-3,5,5-trimethylcyclohex-3-en-1-one

C13H18O2 (206.1306728)


3-oxo-beta-damascone is a member of the class of compounds known as cyclohexenones. Cyclohexenones are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond. 3-oxo-beta-damascone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 3-oxo-beta-damascone can be found in common grape, which makes 3-oxo-beta-damascone a potential biomarker for the consumption of this food product.

   

9-Hydroxymegastigma-4,6,7-trien-3-one

4-(3-hydroxybut-1-en-1-ylidene)-3,5,5-trimethylcyclohex-2-en-1-one

C13H18O2 (206.1306728)


9-hydroxymegastigma-4,6,7-trien-3-one is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. 9-hydroxymegastigma-4,6,7-trien-3-one is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 9-hydroxymegastigma-4,6,7-trien-3-one can be found in common grape, which makes 9-hydroxymegastigma-4,6,7-trien-3-one a potential biomarker for the consumption of this food product.

   

alpha-3-Oxo-damascone

(4S)-4-[(2E)-but-2-enoyl]-3,5,5-trimethylcyclohex-2-en-1-one

C13H18O2 (206.1306728)


Alpha-3-oxo-damascone is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Alpha-3-oxo-damascone can be found in common grape, which makes alpha-3-oxo-damascone a potential biomarker for the consumption of this food product.

   

3-Oxo-alpha-lonone

3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one

C13H18O2 (206.1306728)


3-oxo-alpha-lonone is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. 3-oxo-alpha-lonone is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 3-oxo-alpha-lonone can be found in common grape, which makes 3-oxo-alpha-lonone a potential biomarker for the consumption of this food product.

   

Zerumbodienone

1-[(S)-2,2-Dimethyl-6-methylenecyclohexane-1beta-yl]-1-pentene-3-one

C14H22O (206.1670562)


Zerumbodienone is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. Zerumbodienone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Zerumbodienone can be found in ginger, which makes zerumbodienone a potential biomarker for the consumption of this food product.

   

(E)-3-oxo-beta-ionone

2,4,4-trimethyl-3-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one

C13H18O2 (206.1306728)


Flavouring compound [Flavornet]

   
   

[S-(R*,S*)]- 3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexen-1-one

[S-(R*,S*)]- 3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexen-1-one

C14H22O (206.1670562)


   

15-Nor-2-acoren-4-one

15-Nor-2-acoren-4-one

C14H22O (206.1670562)


   

2,6,10-Trimethyl-2,6,10-dodecatriene

2,6,10-Trimethyl-2,6,10-dodecatriene

C15H26 (206.2034396)


   
   

trans-(+-)-2-Methyl-5-(2-methyl-5-isopropenyltetrahydro-2-furyl)furan

trans-(+-)-2-Methyl-5-(2-methyl-5-isopropenyltetrahydro-2-furyl)furan

C13H18O2 (206.1306728)


   
   

3-Buten-2-one, 4-(2,5,6,6-tetramethyl-1(or 2)-cyclohexen-1-yl)-

3-Buten-2-one, 4-(2,5,6,6-tetramethyl-1(or 2)-cyclohexen-1-yl)-

C14H22O (206.1670562)


   

Rudbeckianone

(E,E)-4,4,8-Trimethyl-2,8-cycloundecadien-1-one

C14H22O (206.1670562)


   
   

Vetispiradiene

Vetispiradiene

C15H26 (206.2034396)


   
   
   

trans-alpha-Irone

trans-alpha-Irone

C14H22O (206.1670562)


   

2-Allyl-5-t-butylhydroquinone

2-Allyl-5-t-butylhydroquinone

C13H18O2 (206.1306728)


   

cis-(+-)-2,3,4,5-Tetrahydro-2,5-dimethyl-5-(1-methylethenyl)-2,2-bifuran

cis-(+-)-2,3,4,5-Tetrahydro-2,5-dimethyl-5-(1-methylethenyl)-2,2-bifuran

C13H18O2 (206.1306728)


   

4-Hydroxy-3,5-diisopropylbenzaldehyde

4-Hydroxy-3,5-Bis(Isopropyl)Benzaldehyde

C13H18O2 (206.1306728)


   

Butoxytriglycol

TRIETHYLENE GLYCOL MONOBUTYL ETHER

C10H22O4 (206.1518012)


   

2,4-Di-t-butylphenol

2,4-Di-tert-butylphenol

C14H22O (206.1670562)


A member of the class of phenols carrying two tert-butyl substituents at positions 2 and 4. CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5472; ORIGINAL_PRECURSOR_SCAN_NO 5470 CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4899; ORIGINAL_PRECURSOR_SCAN_NO 4898 CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4900; ORIGINAL_PRECURSOR_SCAN_NO 4898 CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5475; ORIGINAL_PRECURSOR_SCAN_NO 5474 CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5519; ORIGINAL_PRECURSOR_SCAN_NO 5518 CONFIDENCE standard compound; INTERNAL_ID 972; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5507; ORIGINAL_PRECURSOR_SCAN_NO 5506 2,4-Di-tert-butylphenol is an endogenous metabolite. 2,4-Di-tert-butylphenol is an endogenous metabolite.

   

2,6-DI-TERT-BUTYLPHENOL

2,6-DI-TERT-BUTYLPHENOL

C14H22O (206.1670562)


CONFIDENCE standard compound; INTERNAL_ID 2297

   

HET0016

N-(4-butyl-2-methylphenyl)-N-hydroxy-methanimidamide

C12H18N2O (206.1419058)


   

Carylophyllene Oxide

Carylophyllene Oxide

C14H22O (206.1670562)


   

Cashmeran

Cashmeran

C14H22O (206.1670562)


CONFIDENCE standard compound; INTERNAL_ID 2448

   

1-methyl-4-(6-methylheptan-2-ylidene)cyclohexene

1-methyl-4-(6-methylheptan-2-ylidene)cyclohexene

C15H26 (206.2034396)


   

(2R*,5R*)-form-2,3,4,5-Tetrahydro-2,5-dimethyl-5-(1-methylethenyl)-2,2-bifuran,

(2R*,5R*)-form-2,3,4,5-Tetrahydro-2,5-dimethyl-5-(1-methylethenyl)-2,2-bifuran,

C13H18O2 (206.1306728)


   

beta-caryophyllene 4,5-alpha-oxide

beta-caryophyllene 4,5-alpha-oxide

C14H22O (206.1670562)


   

6-Methyl-3-(4-methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde

6-Methyl-3-(4-methyl-3-pentenyl)-3-cyclohexene-1-carbaldehyde

C14H22O (206.1670562)


   
   

3-Buten-2-one, 4-(2,2,3-trimethyl-6-methylenecyclohexyl)-

3-Buten-2-one, 4-(2,2,3-trimethyl-6-methylenecyclohexyl)-

C14H22O (206.1670562)


   

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undecane

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undecane

C15H26 (206.2034396)


   

15-nor-13-keto-beta-elemene

15-nor-13-keto-beta-elemene

C14H22O (206.1670562)


   

8,9-dinorborn-5-en-2-exo-yl pentyl ketone

8,9-dinorborn-5-en-2-exo-yl pentyl ketone

C14H22O (206.1670562)


   
   
   

1-[4-METHYL-5-(3-METHYL-2-BUTENYL)-3-CYCLOHEXEN-1-YL]ETHAN-1-ONE

1-[4-METHYL-5-(3-METHYL-2-BUTENYL)-3-CYCLOHEXEN-1-YL]ETHAN-1-ONE

C14H22O (206.1670562)


   

5-methyl-8,9,10-trinorborn-5-en-2-exo-yl pentyl ketone

5-methyl-8,9,10-trinorborn-5-en-2-exo-yl pentyl ketone

C14H22O (206.1670562)


   

beta-selinene

beta-selinene

C15H26 (206.2034396)


   

8-ISOPROPYL-5-METHYL-4,4A,5,6,7,8-HEXAHYDRONAPHTHALEN-2(3H)-ONE

8-ISOPROPYL-5-METHYL-4,4A,5,6,7,8-HEXAHYDRONAPHTHALEN-2(3H)-ONE

C14H22O (206.1670562)


   

6-methyl-8,9,10-trinorborn-5-en-2-exo-yl pentyl ketone

6-methyl-8,9,10-trinorborn-5-en-2-exo-yl pentyl ketone

C14H22O (206.1670562)


   

11-Nor-8-drimen-7-one

11-Nor-8-drimen-7-one

C14H22O (206.1670562)


   

(+)-spathulenol|spathulenol

(+)-spathulenol|spathulenol

C14H22O (206.1670562)


   

3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexene-1-one

3-Methyl-6-(1-methyl-5-hexenyl)-2-cyclohexene-1-one

C14H22O (206.1670562)


   

8(12)-Drimene

8(12)-Drimene

C15H26 (206.2034396)


   
   

(8R)-Isopropyl-(1,5Xi)-dimethyl-cyclodeca-1-trans,6-trans-dien|4,5,9,10-Didehydro-germacran|Germacren D

(8R)-Isopropyl-(1,5Xi)-dimethyl-cyclodeca-1-trans,6-trans-dien|4,5,9,10-Didehydro-germacran|Germacren D

C15H26 (206.2034396)


   

1-[3-METHYL-2-(3-METHYL-2-BUTENYL)-3-CYCLOHEXEN-1-YL]ETHAN-1-ONE

1-[3-METHYL-2-(3-METHYL-2-BUTENYL)-3-CYCLOHEXEN-1-YL]ETHAN-1-ONE

C14H22O (206.1670562)


   

SCHEMBL16812865

SCHEMBL16812865

C14H22O (206.1670562)


   

(+)-drim-8-ene|12,13,14,15,16-Pentanorlabd-8-en, (+)-1,1,4a,5,6-Pentamethyl-Delta5-octahydronaphthalin

(+)-drim-8-ene|12,13,14,15,16-Pentanorlabd-8-en, (+)-1,1,4a,5,6-Pentamethyl-Delta5-octahydronaphthalin

C15H26 (206.2034396)


   
   

all trans-Tridecatrien-(4,8,10)-in-(6)-diol-(2,3)|trideca-4t,8t,10t-trien-6-yne-2,3-diol

all trans-Tridecatrien-(4,8,10)-in-(6)-diol-(2,3)|trideca-4t,8t,10t-trien-6-yne-2,3-diol

C13H18O2 (206.1306728)


   

(+)-(S)-1,5-dimethyl-7-(1-methylethenyl)-cyclodeca-1E,5E-diene|(+)-(S)-isogermacrene A

(+)-(S)-1,5-dimethyl-7-(1-methylethenyl)-cyclodeca-1E,5E-diene|(+)-(S)-isogermacrene A

C15H26 (206.2034396)


   
   

siliphinene|silphinene

siliphinene|silphinene

C15H26 (206.2034396)


   

Patchoulane

OCTAHYDRO-1,4,9,9-TETRAMETHYL-1H-3A,7-METHANOAZULENE

C15H26 (206.2034396)


   

Etrogol

2-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}ethan-1-ol

C13H18O2 (206.1306728)


A natural product found in Stachylidium species.

   
   

1H-Cycloprop[e]azulene, decahydro-1,1,4,7-tetramethyl-, [1aR-(1a.alpha.,4.beta.,4a.beta.,7.beta.,7a.beta.,7b.alpha.)]-

1H-Cycloprop[e]azulene, decahydro-1,1,4,7-tetramethyl-, [1aR-(1a.alpha.,4.beta.,4a.beta.,7.beta.,7a.beta.,7b.alpha.)]-

C15H26 (206.2034396)


   

Volvalerenic acid A

Volvalerenic acid A

C13H18O2 (206.1306728)


   

9,11,13-tetradecatrienal

9,11,13-tetradecatrienal

C14H22O (206.1670562)


   

(2E,4E)-2,6,10-Trimethylundeca-2,4,9-trienal

(2E,4E)-2,6,10-Trimethylundeca-2,4,9-trienal

C14H22O (206.1670562)


   

6-hydroxybisabolene-1-one

6-hydroxybisabolene-1-one

C13H18O2 (206.1306728)


   

Benzene, (3,3-diethoxy-1-propenyl)-

Benzene, (3,3-diethoxy-1-propenyl)-

C13H18O2 (206.1306728)


   
   

2,6,10-trimethyldodeca-2,6,10-triene

2,6,10-trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)


   

3-Heptanone, 5-hydroxy-7-phenyl-

3-Heptanone, 5-hydroxy-7-phenyl-

C13H18O2 (206.1306728)


   

EINECS 272-672-5

EINECS 272-672-5

C15H26 (206.2034396)


   

(7E,9Z)-2,10-dimethyl-dodeca-2,7,9,11-tetraen-6-ol

(7E,9Z)-2,10-dimethyl-dodeca-2,7,9,11-tetraen-6-ol

C14H22O (206.1670562)


   
   

(+)-Norpatchoulenol

(+)-Norpatchoulenol

C14H22O (206.1670562)


   

Isobutyl thymyl ether

Isobutyl thymyl ether

C14H22O (206.1670562)


   

Eremophil-11-en|eremophil-11-ene|eremophilene

Eremophil-11-en|eremophil-11-ene|eremophilene

C15H26 (206.2034396)


   

(-)-(1S,2S,3S)-1-ethenyl-1-methyl-2,3-di(1-methylethenyl)-cyclohexane|(-)-(5S,6S,10S)-iso-beta-elemene

(-)-(1S,2S,3S)-1-ethenyl-1-methyl-2,3-di(1-methylethenyl)-cyclohexane|(-)-(5S,6S,10S)-iso-beta-elemene

C15H26 (206.2034396)


   
   
   

(1S,4S,7R)-4,8,8-trimethyl-2-methylenebicyclo[5.2.0]nonane-4-carbaldehyde|birkenal

(1S,4S,7R)-4,8,8-trimethyl-2-methylenebicyclo[5.2.0]nonane-4-carbaldehyde|birkenal

C14H22O (206.1670562)


   

cadina-1(10)-ene

cadina-1(10)-ene

C15H26 (206.2034396)


   

(+)-valencene|Dihydrovalencen|valencene

(+)-valencene|Dihydrovalencen|valencene

C15H26 (206.2034396)


   

(E)-6-(but-2-en-2-yl)-3-isobutyl-2H-pyran-2-one|6-((2E)-buten-2-yl)-3-isobutyl-2H-pyran-2-one|nocapyrone H

(E)-6-(but-2-en-2-yl)-3-isobutyl-2H-pyran-2-one|6-((2E)-buten-2-yl)-3-isobutyl-2H-pyran-2-one|nocapyrone H

C13H18O2 (206.1306728)


   

3,4-dehydrothespirone

3,4-dehydrothespirone

C13H18O2 (206.1306728)


   

(E)-6-(but-2-en-2-yl)-3-butyl-2H-pyran-2-one|nocapyrone J

(E)-6-(but-2-en-2-yl)-3-butyl-2H-pyran-2-one|nocapyrone J

C13H18O2 (206.1306728)


   
   
   

3-hydroxy-beta-damascenone

3-hydroxy-beta-damascenone

C13H18O2 (206.1306728)


   

2,6,11-trimethyl-dodeca-2,6,10-triene

2,6,11-trimethyl-dodeca-2,6,10-triene

C15H26 (206.2034396)


   

3,7,11-trimethyldodeca-1,6,10-triene

3,7,11-trimethyldodeca-1,6,10-triene

C15H26 (206.2034396)


   

Desoxydihydro-Delta4-guajol

Desoxydihydro-Delta4-guajol

C15H26 (206.2034396)


   

N-(5-aminopentyl)benzamide

N-(5-aminopentyl)benzamide

C12H18N2O (206.1419058)


   
   

2,3,4,5-Tetrahydro-2,5-dimethyl-5-isopropenyl-2,2-bifuran

2,3,4,5-Tetrahydro-2,5-dimethyl-5-isopropenyl-2,2-bifuran

C13H18O2 (206.1306728)


   

2,4,4-trimethyl-3-(3-oxobut-1-enyl)cyclohex-2-en-1-one

2,4,4-trimethyl-3-(3-oxobut-1-enyl)cyclohex-2-en-1-one

C13H18O2 (206.1306728)


   

.gamma.-coronal

.gamma.-coronal

C14H22O (206.1670562)


   

4a,8,8-Trimethyloctahydrocyclopropa[d]naphthalen-2(3H)-one #

4a,8,8-Trimethyloctahydrocyclopropa[d]naphthalen-2(3H)-one #

C14H22O (206.1670562)


   

DTXSID40486723

DTXSID40486723

C15H26 (206.2034396)


   

9-hydroxy-13-norhumulene-1(11)E,4E,8(14)-triene|gibberosin N

9-hydroxy-13-norhumulene-1(11)E,4E,8(14)-triene|gibberosin N

C14H22O (206.1670562)


   

4-Desmethyl caryophylla-8(14)-en-5-one

4-Desmethyl caryophylla-8(14)-en-5-one

C14H22O (206.1670562)


   

6-methyl-4-(4-methylpent-3-en-1-yl)cyclohex-3-ene-1-carbaldehyde

6-methyl-4-(4-methylpent-3-en-1-yl)cyclohex-3-ene-1-carbaldehyde

C14H22O (206.1670562)


   
   

(+)-3-hydroxy-7,8-dehydro-beta-ionone|(+/-)-3-hydroxy-7,8-dehydro-beta-ionone

(+)-3-hydroxy-7,8-dehydro-beta-ionone|(+/-)-3-hydroxy-7,8-dehydro-beta-ionone

C13H18O2 (206.1306728)


   
   

13-Nor-6-eudesmen-8-one

13-Nor-6-eudesmen-8-one

C14H22O (206.1670562)


   
   

5,8a-dimethyl-3-propan-2-yl-2,3,4,4a,7,8-hexahydro-1H-naphthalene

5,8a-dimethyl-3-propan-2-yl-2,3,4,4a,7,8-hexahydro-1H-naphthalene

C15H26 (206.2034396)


   

3,7-dimethyloctane-1,2,6,7-tetrol

3,7-dimethyloctane-1,2,6,7-tetrol

C10H22O4 (206.1518012)


   

(-)-germacrene D|1,14,4,5-Didehydro-germacran|5,6-Dihydro-Germacrene D

(-)-germacrene D|1,14,4,5-Didehydro-germacran|5,6-Dihydro-Germacrene D

C15H26 (206.2034396)


   

3a,7-Methano-3aH-cyclopentacyclooctene, decahydro-1,1,7-trimethyl-, stereoisomer

3a,7-Methano-3aH-cyclopentacyclooctene, decahydro-1,1,7-trimethyl-, stereoisomer

C15H26 (206.2034396)


   
   
   

ibuprofen

(S)-(+)-Ibuprofen

C13H18O2 (206.1306728)


M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain > M02AA - Antiinflammatory preparations, non-steroids for topical use M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AE - Propionic acid derivatives G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CC - Antiinflammatory products for vaginal administration D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials, DrugBank R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor C - Cardiovascular system > C01 - Cardiac therapy D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 1283; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4853; ORIGINAL_PRECURSOR_SCAN_NO 4851 CONFIDENCE standard compound; INTERNAL_ID 1283; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4862; ORIGINAL_PRECURSOR_SCAN_NO 4858 CONFIDENCE standard compound; INTERNAL_ID 2345 CONFIDENCE standard compound; EAWAG_UCHEM_ID 203

   

MLS000766260-01!Oxotremorine

MLS000766260-01!Oxotremorine

C12H18N2O (206.1419058)


   

OP (TENTATIVE)

OP (TENTATIVE)

C14H22O (206.1670562)


TENTATIVELY IDENTIFIED SPECTRUM ONLY!!!!!!!!!; Extracted (without noise removal) from ZWI_N: mz207_17_rt14_11_HCD75_OP; CONFIDENCE Tentative identification: best match only (Level 3)

   

ISOPROTURON

Pesticide3_Isoproturon_C12H18N2O_Arelon

C12H18N2O (206.1419058)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

Norlidocaine

Norlidocaine

C12H18N2O (206.1419058)


CONFIDENCE Reference Standard (Level 1)

   

UNII:862GFQ832E

2,6-Di(butan-2-yl)phenol

C14H22O (206.1670562)


CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5472; ORIGINAL_PRECURSOR_SCAN_NO 5470 CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5486; ORIGINAL_PRECURSOR_SCAN_NO 5483 CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5452; ORIGINAL_PRECURSOR_SCAN_NO 5448 CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5475; ORIGINAL_PRECURSOR_SCAN_NO 5474 CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5519; ORIGINAL_PRECURSOR_SCAN_NO 5518 CONFIDENCE standard compound; INTERNAL_ID 1057; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5507; ORIGINAL_PRECURSOR_SCAN_NO 5506

   

Longicamphenylone

Longicamphenylone

C14H22O (206.1670562)


   

15-NORCARYOPHYLLEN-3-ONE

15-NORCARYOPHYLLEN-3-ONE

C14H22O (206.1670562)


   

9Z,11E,13-Tetradecatrienal

9Z,11E,13-Tetradecatrienal

C14H22O (206.1670562)


   

(+)-Mayurone

(+)-15-nor-4-thujopsen-3-one

C14H22O (206.1670562)


   

Eremopetasinorone A

2-acetyl-3a,4-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-inden-5-one

C13H18O2 (206.1306728)


   

D-Methylionone

(3E)-3-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one

C14H22O (206.1670562)


   

α-Cetone

(3E)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one

C14H22O (206.1670562)


D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids

   

Benzyl caproate

Hexanoic acid, phenylmethyl ester

C13H18O2 (206.1306728)


   

delta-Methylionone

(1E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one

C14H22O (206.1670562)


   

(E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one

(3E)-6-methyl-6-(5-methylfuran-2-yl)hept-3-en-2-one

C13H18O2 (206.1306728)


   

FEMA 2891

Butanoic acid, 2-phenylpropyl ester

C13H18O2 (206.1306728)


   

FEMA 2892

2-phenylpropyl 2-methylpropanoate

C13H18O2 (206.1306728)


   

Centifolia

Benzenepropanol, alpha,alpha-dimethyl-, 1-acetate

C13H18O2 (206.1306728)


   

FEMA 2081

Benzeneacetic acid, 3-methylbutyl ester

C13H18O2 (206.1306728)


   

Phenethyl valerate

Pentanoic acid, 2-phenylethyl ester

C13H18O2 (206.1306728)


   

FEMA 2871

Butanoic acid, 3-methyl-, 2-phenylethyl ester

C13H18O2 (206.1306728)


   

xi-8,9-Dehydrotheaspirone

2,6,10,10-tetramethyl-1-oxaspiro[4.5]deca-2,6-dien-8-one

C13H18O2 (206.1306728)


   

methylionone

(1E)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one

C14H22O (206.1670562)


   

etaspirene

6-ethyl-2,10,10-trimethyl-1-oxaspiro[4.5]deca-3,6-diene

C14H22O (206.1670562)


   

Neocaspirene

2,7-Dimethyl-10-(1-methylethyl)-1-oxaspiro[4.5]deca-3,6-diene, 9ci

C14H22O (206.1670562)


   

Floralate

2,4,6-trimethyl-4-phenyl-1,3-dioxane

C13H18O2 (206.1306728)


   

FEMA 2690

Benzeneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester

C13H18O2 (206.1306728)


Methyl p-tert-butylphenylacetate is an endogenous metabolite.

   

FEMA 2424

Butyric acid, alpha-ethylbenzyl ester

C13H18O2 (206.1306728)


   

FEMA 3197

alpha-methyl phenethyl butyrate

C13H18O2 (206.1306728)


   

FEMA 3341

Benzenepropanoic acid, alpha-ethyl-, ethyl ester

C13H18O2 (206.1306728)


   

10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al

8,8a-dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carbaldehyde

C13H18O2 (206.1306728)


   

FEMA 2388

Propanoic acid, 2-methyl-, 1-methyl-1-phenylethyl ester

C13H18O2 (206.1306728)


   

FEMA 3632

Butanoic acid, 2-methyl-, 2-phenylethyl ester

C13H18O2 (206.1306728)


   

Methyl ionone

(1E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one

C14H22O (206.1670562)


   

Amylphenyl acetate

Acetic acid, phenyl-, pentyl ester (8ci)

C13H18O2 (206.1306728)


   

Agrocybenine

1,2,3,5-tetrahydro-2,2,5,5,7-Pentamethyl-6H-pyrrolo[2,3-b]pyridin-6-one, 9ci

C12H18N2O (206.1419058)


   

2,6E,10E-Trimethyl-2,6,10-dodecatriene

2,6E,10E-Trimethyl-2,6,10-dodecatriene

C15H26 (206.2034396)


   

3,7,11-Trimethyl-1,3E,6E,10-dodecatetraene

3,7,11-Trimethyl-1,3E,6E,10-dodecatetraene

C15H26 (206.2034396)


   

3,7,11-Trimethyl-2E,4E,10-dodecatriene

3,7,11-Trimethyl-2E,4E,10-dodecatriene

C15H26 (206.2034396)


   

3,7,11-Trimethyl-1,3E,6Z,10-dodecatetraene

3,7,11-Trimethyl-1,3E,6Z,10-dodecatetraene

C15H26 (206.2034396)


   

2,6,10-Trimethyl-2,6Z,10-dodecatriene

2,6,10-Trimethyl-2,6Z,10-dodecatriene

C15H26 (206.2034396)


   

7,11-Dimethyl-3-methylene-1,6Z,10-dodecatriene

7,11-Dimethyl-3-methylene-1,6Z,10-dodecatriene

C15H26 (206.2034396)


   

3,7,11-Trimethyl-1,3Z,6E,10-dodecatetraene

3,7,11-Trimethyl-1,3Z,6E,10-dodecatetraene

C15H26 (206.2034396)


   

3,7,11-Trimethyl-2Z,4E,10-dodecatriene

3,7,11-Trimethyl-2Z,4E,10-dodecatriene

C15H26 (206.2034396)


   

FA 13:4

7-phenyl-heptanoic acid

C13H18O2 (206.1306728)


   

FAL 14:3

9Z,11E,13-Tetradecatrienal

C14H22O (206.1670562)


   

SFE 13:4

Ethyl 2-ethyl-3-phenylpropanoate

C13H18O2 (206.1306728)


   

8-hydroxy-3E,5E,10E,12-tridecatetraen-2-one

8-hydroxy-3E,5E,10E,12-tridecatetraen-2-one

C13H18O2 (206.1306728)


   

2-SEC-4-TERT BUTYLPHENOL

2-SEC-4-TERT BUTYLPHENOL

C14H22O (206.1670562)


   
   
   

7-Phenylheptanoic acid

7-Phenylheptanoic acid

C13H18O2 (206.1306728)


   

2-Morpholin-4-yl-1-phenyl-ethylamine

2-Morpholin-4-yl-1-phenyl-ethylamine

C12H18N2O (206.1419058)


   

Octylphenol

Phenol, 2-(1,1,3,3-tetramethylbutyl)-

C14H22O (206.1670562)


   

3-(2-Aminoethylamino)propyl-dimethoxymethylsilane

3-(2-Aminoethylamino)propyl-dimethoxymethylsilane

C8H22N2O2Si (206.14504720000002)


   

1-(Pyridin-3-ylmethyl)piperidine-3-methanol

1-(Pyridin-3-ylmethyl)piperidine-3-methanol

C12H18N2O (206.1419058)


   

2-(4-butylphenyl)propanoic acid

2-(4-butylphenyl)propanoic acid

C13H18O2 (206.1306728)


   

2-[4-(2-AMINO-ETHYL)-PHENYL]-N,N-DIMETHYL-ACETAMIDE

2-[4-(2-AMINO-ETHYL)-PHENYL]-N,N-DIMETHYL-ACETAMIDE

C12H18N2O (206.1419058)


   

(4-Benzyl-2-piperazinyl)methanol

(4-Benzyl-2-piperazinyl)methanol

C12H18N2O (206.1419058)


   

[1-(4-Pyridinylmethyl)-4-piperidinyl]methanol

[1-(4-Pyridinylmethyl)-4-piperidinyl]methanol

C12H18N2O (206.1419058)


   
   

1-(4-Ethoxyphenyl)piperazine

1-(4-Ethoxyphenyl)piperazine

C12H18N2O (206.1419058)


   

methyl 2-(4-ethylphenyl)-2-methylpropanoate

methyl 2-(4-ethylphenyl)-2-methylpropanoate

C13H18O2 (206.1306728)


   

Benzenebutanoic acid, b-ethyl-b-methyl-

Benzenebutanoic acid, b-ethyl-b-methyl-

C13H18O2 (206.1306728)


   

Benzaldehyde, 3-(1,1-dimethylethyl)-4-ethoxy- (9CI)

Benzaldehyde, 3-(1,1-dimethylethyl)-4-ethoxy- (9CI)

C13H18O2 (206.1306728)


   

Benzaldehyde, 5-(1,1-dimethylethyl)-2-ethoxy- (9CI)

Benzaldehyde, 5-(1,1-dimethylethyl)-2-ethoxy- (9CI)

C13H18O2 (206.1306728)


   

Acetamide, N-(4-(diethylamino)phenyl)- (9CI)

Acetamide, N-(4-(diethylamino)phenyl)- (9CI)

C12H18N2O (206.1419058)


   

3-(piperidin-4-ylmethoxymethyl)pyridine

3-(piperidin-4-ylmethoxymethyl)pyridine

C12H18N2O (206.1419058)


   

alpha-methyl ional

alpha-methyl ional

C14H22O (206.1670562)


   

1-[4-(2-methylpropoxy)phenyl]propan-1-one

1-[4-(2-methylpropoxy)phenyl]propan-1-one

C13H18O2 (206.1306728)


   

3,5-Di-tert-butylphenol

3,5-Di-tert-butylphenol

C14H22O (206.1670562)


3,5-Di-tert-butylphenol is an volatile organic compound with anti-biofilm and antifungal activities. 3,5-Di-tert-butylphenol induces accumulation of reactive oxygen species (ROS). 3,5-Di-tert-butylphenol is an volatile organic compound with anti-biofilm and antifungal activities. 3,5-Di-tert-butylphenol induces accumulation of reactive oxygen species (ROS).

   

3-(4-tert-butylphenyl)propanoic acid

3-(4-tert-butylphenyl)propanoic acid

C13H18O2 (206.1306728)


   

tripropylene glycol monomethyl ether

2-Propanol, 1-[2-(2-methoxy-1-methylethoxy)-1-methylethoxy]-

C10H22O4 (206.1518012)


   

3-Phenylpropyl butyrate

Butyric acid, 3-phenylpropyl ester

C13H18O2 (206.1306728)


   

n,n-dibutylpyridin-4-amine

n,n-dibutylpyridin-4-amine

C13H22N2 (206.1782892)


   

DEA NONOate (Diethylamine nonoate)

DEA NONOate (Diethylamine nonoate)

C8H22N4O2 (206.1742672)


   

1-(2-Ethoxyphenyl)piperazine

1-(2-Ethoxyphenyl)piperazine

C12H18N2O (206.1419058)


   
   

4-(2,6-dimethylmorpholin-4-yl)aniline

4-(2,6-dimethylmorpholin-4-yl)aniline

C12H18N2O (206.1419058)


   

N1,N1-DIETHYL-3-PHENYLPROPANE-1,3-DIAMINE

N1,N1-DIETHYL-3-PHENYLPROPANE-1,3-DIAMINE

C13H22N2 (206.1782892)


   

2,4-DIISOPROPYLBENZOIC ACID

2,4-DIISOPROPYLBENZOIC ACID

C13H18O2 (206.1306728)


   

2-[(3-methoxyphenyl)methyl]piperazine

2-[(3-methoxyphenyl)methyl]piperazine

C12H18N2O (206.1419058)


   

1-(4-methoxyphenyl)-3,3-dimethylbutan-1-one

1-(4-methoxyphenyl)-3,3-dimethylbutan-1-one

C13H18O2 (206.1306728)


   

DEA NONOate

Diethylamine NONOate diethylammonium salt

C8H22N4O2 (206.1742672)


   

(2,2,9,9-2H4)Decanedioic acid

(2,2,9,9-2H4)Decanedioic acid

C10H14D4O4 (206.145611512)


   

Methyl 4-tert-butylphenylacetate

Methyl 4-tert-butylphenylacetate

C13H18O2 (206.1306728)


   

1-(4-METHOXYPHENYL)-2-METHYLPIPERAZINE, 1:1 MIXTURE OF CONFORMERS

1-(4-METHOXYPHENYL)-2-METHYLPIPERAZINE, 1:1 MIXTURE OF CONFORMERS

C12H18N2O (206.1419058)


   

Benzenepropanal, 4-butoxy-

Benzenepropanal, 4-butoxy-

C13H18O2 (206.1306728)


   

2-[(5-methyl-2-propan-2-ylphenoxy)methyl]oxirane

2-[(5-methyl-2-propan-2-ylphenoxy)methyl]oxirane

C13H18O2 (206.1306728)


   

2-{[2-(2-Methyl-2-propanyl)phenoxy]methyl}oxirane

2-{[2-(2-Methyl-2-propanyl)phenoxy]methyl}oxirane

C13H18O2 (206.1306728)


   

1-(4-ethylphenyl)-1-propylurea

1-(4-ethylphenyl)-1-propylurea

C12H18N2O (206.1419058)


   

(1-Benzylpiperazin-2-yl)methanol

(1-Benzylpiperazin-2-yl)methanol

C12H18N2O (206.1419058)


   

1-(3-methoxyphenyl)-1,4-diazepane

1-(3-methoxyphenyl)-1,4-diazepane

C12H18N2O (206.1419058)


   

4-(4-propylphenyl)butanoic acid

4-(4-propylphenyl)butanoic acid

C13H18O2 (206.1306728)


   

4-Pentylphenyl acetic acid

2-(4-Pentylphenyl)acetic acid

C13H18O2 (206.1306728)


   
   
   

[3-(morpholinomethyl)phenyl]methylamine

[3-(morpholinomethyl)phenyl]methylamine

C12H18N2O (206.1419058)


   

1-[2-(4-Morpholinylmethyl)phenyl]methanamine

1-[2-(4-Morpholinylmethyl)phenyl]methanamine

C12H18N2O (206.1419058)


   

ETHYL 1,6-DIMETHYL-2-OXO-4-PHENYL-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBOXYLATE

ETHYL 1,6-DIMETHYL-2-OXO-4-PHENYL-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBOXYLATE

C12H18N2O (206.1419058)


   

1-[(2-HYDROXY-1-NAPHTHYL)(4-METHOXYPHENYL)METHYL]-2-NAPHTHOL

1-[(2-HYDROXY-1-NAPHTHYL)(4-METHOXYPHENYL)METHYL]-2-NAPHTHOL

C12H18N2O (206.1419058)


   

5-METHYL-S-TRIAZOLO[1,5-A]PYRIMIDIN-7-OL

5-METHYL-S-TRIAZOLO[1,5-A]PYRIMIDIN-7-OL

C12H18N2O (206.1419058)


   
   

2,6-Diisopropylphenylboronic acid

2,6-Diisopropylphenylboronic acid

C12H19BO2 (206.14780240000002)


   
   

3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5-yl propionate

3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5-yl propionate

C13H18O2 (206.1306728)


   

1-(4-METHOXY-2-METHYL-PHENYL)-PIPERAZINE

1-(4-METHOXY-2-METHYL-PHENYL)-PIPERAZINE

C12H18N2O (206.1419058)


   

N-METHYL-4-(4-MORPHOLINYL)BENZYLAMINE

N-METHYL-4-(4-MORPHOLINYL)BENZYLAMINE

C12H18N2O (206.1419058)


   

Ethyl 2,2-dimethyl-3-phenylpropanoate

Ethyl 2,2-dimethyl-3-phenylpropanoate

C13H18O2 (206.1306728)


   

2-Propenoic acid, octahydro-4,7-methano-1H-​inden-5-yl ester

2-Propenoic acid, octahydro-4,7-methano-1H-​inden-5-yl ester

C13H18O2 (206.1306728)


   

1-Methyl-4-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde

1-Methyl-4-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde

C14H22O (206.1670562)


   
   

(R)-(-)-Ibuprofen

(R)-(-)-Ibuprofen

C13H18O2 (206.1306728)


   

2-hydroxy-2-methyl-1-(4-propan-2-ylphenyl)propan-1-one

2-hydroxy-2-methyl-1-(4-propan-2-ylphenyl)propan-1-one

C13H18O2 (206.1306728)


   

2-(4-(PYRIDIN-2-YL)PIPERAZIN-1-YL)ETHANAMINE

2-(4-(PYRIDIN-2-YL)PIPERAZIN-1-YL)ETHANAMINE

C11H18N4 (206.1531388)


   

1-(2-Methoxyphenyl)-3-methylpiperazine

1-(2-Methoxyphenyl)-3-methylpiperazine

C12H18N2O (206.1419058)


   

2-(2,3,4,5,6-pentamethylphenyl)acetic acid

2-(2,3,4,5,6-pentamethylphenyl)acetic acid

C13H18O2 (206.1306728)


   

4-(2,2,3,3-tetramethylbutyl)phenol

4-(2,2,3,3-tetramethylbutyl)phenol

C14H22O (206.1670562)


   

(S)-4-BENZYL-2-HYDROXYMETHYLPIPERAZINE

(S)-4-BENZYL-2-HYDROXYMETHYLPIPERAZINE

C12H18N2O (206.1419058)


   

(R)-4-BENZYL-2-HYDROXYMETHYLPIPERAZINE

(R)-4-BENZYL-2-HYDROXYMETHYLPIPERAZINE

C12H18N2O (206.1419058)


   

4-[2-(dimethylamino)ethyl-methylamino]benzaldehyde

4-[2-(dimethylamino)ethyl-methylamino]benzaldehyde

C12H18N2O (206.1419058)


   

5-(3,4-dimethylphenyl)pentanoic acid

5-(3,4-dimethylphenyl)pentanoic acid

C13H18O2 (206.1306728)


   

4-(Octylamino)pyridine

4-(Octylamino)pyridine

C13H22N2 (206.1782892)


   

(4-Benzyl-1,4-Oxazinan-2-Yl)Methylamine

(4-Benzyl-1,4-Oxazinan-2-Yl)Methylamine

C12H18N2O (206.1419058)


   

4-(4-Methylpiperazino)-1,2-benzenediamine

4-(4-Methylpiperazino)-1,2-benzenediamine

C11H18N4 (206.1531388)


   

1-[4-(3-METHYL-BUTOXY)-PHENYL]-ETHANONE

1-[4-(3-METHYL-BUTOXY)-PHENYL]-ETHANONE

C13H18O2 (206.1306728)


   

2,5-Bis(1-methylpropyl)phenol

2,5-Bis(1-methylpropyl)phenol

C14H22O (206.1670562)


   

2,3-Dimethyl-4-(1-piperazinyl)phenol

2,3-Dimethyl-4-(1-piperazinyl)phenol

C12H18N2O (206.1419058)


   

2-(4-Morpholinyl)-2-phenylethanamine

2-(4-Morpholinyl)-2-phenylethanamine

C12H18N2O (206.1419058)


   

Benzenamine, 3-[(1-methyl-4-piperidinyl)oxy]- (9CI)

Benzenamine, 3-[(1-methyl-4-piperidinyl)oxy]- (9CI)

C12H18N2O (206.1419058)


   

8-Phenyl-1-octanol

8-Phenyl-1-octanol

C14H22O (206.1670562)


   

2-HYDROXYPHENETHYLALCOHOL

2-HYDROXYPHENETHYLALCOHOL

C12H18N2O (206.1419058)


   

N,N-di(propan-2-yl)pyridine-4-carboxamide

N,N-di(propan-2-yl)pyridine-4-carboxamide

C12H18N2O (206.1419058)


   
   

4-Hydroxyphenyl hexyl ketone

4-Hydroxyphenyl hexyl ketone

C13H18O2 (206.1306728)


   

m-Isobutyl Ibuprofen

m-Isobutyl Ibuprofen

C13H18O2 (206.1306728)


   

Phenol,2,4-bis(1-methylpropyl)-

Phenol,2,4-bis(1-methylpropyl)-

C14H22O (206.1670562)


   

1-(3-MORPHOLINOPHENYL)ETHANAMINE

1-(3-MORPHOLINOPHENYL)ETHANAMINE

C12H18N2O (206.1419058)


   

1-(4-AMINO-5-CHLORO-2-METHOXY-PHENYL)-ETHANONE

1-(4-AMINO-5-CHLORO-2-METHOXY-PHENYL)-ETHANONE

C12H18N2O (206.1419058)


   

1-(3-Methoxybenzyl)piperazine

1-(3-Methoxybenzyl)piperazine

C12H18N2O (206.1419058)


   

Benzaldehyde,2-(hexyloxy)-

Benzaldehyde,2-(hexyloxy)-

C13H18O2 (206.1306728)


   

Sodium(tetra-n-propyl)borate

Sodium(tetra-n-propyl)borate

C12H28BNa (206.2181638)


   

1-(3-METHOXYPHENYL)CYCLOHEXANOL

1-(3-METHOXYPHENYL)CYCLOHEXANOL

C13H18O2 (206.1306728)


   

(4S,5S)-(-)-4-METHOXYMETHYL-2-METHYL-5-PHENYL-2-OXAZOLINE

(4S,5S)-(-)-4-METHOXYMETHYL-2-METHYL-5-PHENYL-2-OXAZOLINE

C13H22N2 (206.1782892)


   

(2,3-Dimethyl-2-butanyl)(trimethoxy)silane

(2,3-Dimethyl-2-butanyl)(trimethoxy)silane

C9H22O3Si (206.13381420000002)


   
   

1-PHENYL-1-OCTANOL

1-PHENYL-1-OCTANOL

C14H22O (206.1670562)


   

ethyl mesitylacetate

ethyl mesitylacetate

C13H18O2 (206.1306728)


   

1-(2-PHENOXYETHYL)-PIPERAZINE

1-(2-PHENOXYETHYL)-PIPERAZINE

C12H18N2O (206.1419058)


   
   

1,2-Bis(diethylphosphino)ethane

1,2-Bis(diethylphosphino)ethane

C10H24P2 (206.1353164)


   

Benzylisopropyl propionate

Dimethyl Benzyl Carbinyl Propionate

C13H18O2 (206.1306728)


   

4-(2-aminoethylamino)-1-phenylbutan-1-one

4-(2-aminoethylamino)-1-phenylbutan-1-one

C12H18N2O (206.1419058)


   

3-(N,N-Diethylamino)acetanilide

3-(N,N-Diethylamino)acetanilide

C12H18N2O (206.1419058)


   

2-ETHYL-4-METHYL-6-PIPERAZIN-1-YL-PYRIMIDINE

2-ETHYL-4-METHYL-6-PIPERAZIN-1-YL-PYRIMIDINE

C11H18N4 (206.1531388)


   

5-(MORPHOLIN-4-YLMETHYL)ISOXAZOLE-3-CARBOXYLIC ACID HYDROCHLORIDE

5-(MORPHOLIN-4-YLMETHYL)ISOXAZOLE-3-CARBOXYLIC ACID HYDROCHLORIDE

C12H18N2O (206.1419058)


   

Dicyclopentanyl acrylate

Dicyclopentanyl acrylate

C13H18O2 (206.1306728)


   

1-(2-AMINOETHYL)-4-PIPERIDINOL2HCL

1-(2-AMINOETHYL)-4-PIPERIDINOL2HCL

C12H18N2O (206.1419058)


   

BENZOIC ACID 2-METHYLPENTYL ESTER

BENZOIC ACID 2-METHYLPENTYL ESTER

C13H18O2 (206.1306728)


   

Ethanone, 1-[4- (pentyloxy)phenyl]-

Ethanone, 1-[4- (pentyloxy)phenyl]-

C13H18O2 (206.1306728)


   

N-ETHYL-2-(PIPERAZIN-1-YL)PYRIDIN-3-AMINE

N-ETHYL-2-(PIPERAZIN-1-YL)PYRIDIN-3-AMINE

C11H18N4 (206.1531388)


   

3-(2-pyrrolidin-1-ylethoxy)aniline

3-(2-pyrrolidin-1-ylethoxy)aniline

C12H18N2O (206.1419058)


   

1-Adamantyl acrylate

1-Adamantyl acrylate

C13H18O2 (206.1306728)


   

N-methyl-2-(morpholin-4-ylmethyl)aniline

N-methyl-2-(morpholin-4-ylmethyl)aniline

C12H18N2O (206.1419058)


   

(4-(4-Methylpiperazin-1-yl)phenyl)methanol

(4-(4-Methylpiperazin-1-yl)phenyl)methanol

C12H18N2O (206.1419058)


   

(1-PYRIDIN-2-YLMETHYLPIPERIDIN-4-YL)METHANOL

(1-PYRIDIN-2-YLMETHYLPIPERIDIN-4-YL)METHANOL

C12H18N2O (206.1419058)


   

[2-(4-Methylpiperazin-1-yl)phenyl]methanol

[2-(4-Methylpiperazin-1-yl)phenyl]methanol

C12H18N2O (206.1419058)


   

4-(1H-PYRAZOL-4-YL)-7-((2-(TRIMETHYLSILYL)ETHOXY)-METHYL)-7H-PYRROLO[2,3-D]PYRIMIDINE

4-(1H-PYRAZOL-4-YL)-7-((2-(TRIMETHYLSILYL)ETHOXY)-METHYL)-7H-PYRROLO[2,3-D]PYRIMIDINE

C12H18N2O (206.1419058)


   

3-HYDROXY-2-METHYL-1-PHENYL-HEXAN-1-ONE

3-HYDROXY-2-METHYL-1-PHENYL-HEXAN-1-ONE

C13H18O2 (206.1306728)


   

para-cresyl hexanoate

Hexanoic acid, 4-methylphenyl ester

C13H18O2 (206.1306728)


   

2-benzyl heptanol

2-benzyl heptanol

C14H22O (206.1670562)


   

Cinnamaldehyde diethyl acetal

Cinnamaldehyde, diethyl acetal

C13H18O2 (206.1306728)


   

[3-(4-Methyl-1-Piperazinyl)Phenyl]Methanol

[3-(4-Methyl-1-Piperazinyl)Phenyl]Methanol

C12H18N2O (206.1419058)


   

4-[(1-Methyl-4-piperidinyl)oxy]aniline

4-[(1-Methyl-4-piperidinyl)oxy]aniline

C12H18N2O (206.1419058)


   

(2-[(1-METHYLPIPERIDIN-4-YL)OXY]PHENYL)AMINE

(2-[(1-METHYLPIPERIDIN-4-YL)OXY]PHENYL)AMINE

C12H18N2O (206.1419058)


   

1-(2-METHOXYBENZYL) PIPERAZINE

1-(2-METHOXYBENZYL) PIPERAZINE

C12H18N2O (206.1419058)


   

4-tert-Butylphenyl glycidyl ether

4-tert-Butylphenyl glycidyl ether

C13H18O2 (206.1306728)


   

2,2,7,7-TETRAMETHYL-2,6,7,8-TETRAHYDRO-CHROMEN-5-ONE

2,2,7,7-TETRAMETHYL-2,6,7,8-TETRAHYDRO-CHROMEN-5-ONE

C13H18O2 (206.1306728)


   

1-(2-METHOXY-ETHYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE

1-(2-METHOXY-ETHYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE

C12H18N2O (206.1419058)


   

4-methoxy-3-piperidin-4-ylaniline

4-methoxy-3-piperidin-4-ylaniline

C12H18N2O (206.1419058)


   
   

2-METHYL-5-PHENYL-PENTANOIC ACID METHYL ESTER

2-METHYL-5-PHENYL-PENTANOIC ACID METHYL ESTER

C13H18O2 (206.1306728)


   

N1-BENZYL-N2-BUTYLETHANE-1,2-DIAMINE

N1-BENZYL-N2-BUTYLETHANE-1,2-DIAMINE

C13H22N2 (206.1782892)


   

[1-(6-methylpyrazin-2-yl)piperidin-3-yl]methanamine

[1-(6-methylpyrazin-2-yl)piperidin-3-yl]methanamine

C11H18N4 (206.1531388)


   

alpha-iso-methylionone

alpha-iso-methylionone

C14H22O (206.1670562)


   

8-ethoxyoctan-1-ol,methane

8-ethoxyoctan-1-ol,methane

C12H30O2 (206.224568)


   
   

Tricyclo[4.2.1.12,5]decan-9-one, 7-ethyl-1,6-dimethyl-, (1R,2S,5R,6R,7S)-rel- (9CI)

Tricyclo[4.2.1.12,5]decan-9-one, 7-ethyl-1,6-dimethyl-, (1R,2S,5R,6R,7S)-rel- (9CI)

C14H22O (206.1670562)


   

3-methyl-4-(3,5,6-trimethyl-3-cyclohexenyl)-3-buten-2-one

3-methyl-4-(3,5,6-trimethyl-3-cyclohexenyl)-3-buten-2-one

C14H22O (206.1670562)


   

3,5,6-trimethyl-3-cyclohexenyl-4-penten-3-one

3,5,6-trimethyl-3-cyclohexenyl-4-penten-3-one

C14H22O (206.1670562)


   

4-methyl-2-[1-(o-tolyl)ethyl]-1,3-dioxolane

4-methyl-2-[1-(o-tolyl)ethyl]-1,3-dioxolane

C13H18O2 (206.1306728)


   

(2R)-4-(Phenylmethyl)-2-MorpholineMethanamine

(2R)-4-(Phenylmethyl)-2-MorpholineMethanamine

C12H18N2O (206.1419058)


   

Ethyl 4-tert-butylbenzoate

Benzoic acid,4-(1,1-dimethylethyl)-, ethyl ester

C13H18O2 (206.1306728)


A benzoate ester obtained by the formal condensation of 4-tert-butylbenzoic acid with ethanol.

   

1-(4-ethylphenyl)-1-propan-2-ylurea

1-(4-ethylphenyl)-1-propan-2-ylurea

C12H18N2O (206.1419058)


   

3-methoxy-4-piperidin-1-ylaniline

3-methoxy-4-piperidin-1-ylaniline

C12H18N2O (206.1419058)


   

(4-Benzylmorpholin-2-yl)-methylamine

(4-Benzylmorpholin-2-yl)-methylamine

C12H18N2O (206.1419058)


   

[1,2,4]Triazolo[4,3-a]pyridine-3-amine

[1,2,4]Triazolo[4,3-a]pyridine-3-amine

C13H18O2 (206.1306728)


   
   

6-[(4-methylpiperazin-1-yl)methyl]pyridin-2-amine

6-[(4-methylpiperazin-1-yl)methyl]pyridin-2-amine

C11H18N4 (206.1531388)


   

2-adamantanyl acrylate

2-adamantanyl acrylate

C13H18O2 (206.1306728)


   

dicyclopentadiene propionate

dicyclopentadiene propionate

C13H18O2 (206.1306728)


   

[6-(Cyclohexyloxy)pyridin-3-yl]methylamine

[6-(Cyclohexyloxy)pyridin-3-yl]methylamine

C12H18N2O (206.1419058)


   

2-[(2-butylphenoxy)methyl]oxirane

2-[(2-butylphenoxy)methyl]oxirane

C13H18O2 (206.1306728)


   

Benzaldehyde, 3-methyl-4-(pentyloxy)- (9CI)

Benzaldehyde, 3-methyl-4-(pentyloxy)- (9CI)

C13H18O2 (206.1306728)


   

Benzaldehyde, 3-methyl-4-(3-methylbutoxy)- (9CI)

Benzaldehyde, 3-methyl-4-(3-methylbutoxy)- (9CI)

C13H18O2 (206.1306728)


   

N-METHYL-N-(3-MORPHOLIN-4-YLBENZYL)AMINE

N-METHYL-N-(3-MORPHOLIN-4-YLBENZYL)AMINE

C12H18N2O (206.1419058)


   

p-sec-octylphenol

p-sec-octylphenol

C14H22O (206.1670562)


   

[1-(4-AMINOPHENYL)PIPERIDIN-4-YL]METHANOL

[1-(4-AMINOPHENYL)PIPERIDIN-4-YL]METHANOL

C12H18N2O (206.1419058)


   

2-[4-(1-Methylpropyl)phenyl] propanoic Acid

2-[4-(1-Methylpropyl)phenyl] propanoic Acid

C13H18O2 (206.1306728)


   
   
   

IBuprofen Impurity 60

IBuprofen Impurity 60

C13H18O2 (206.1306728)


   

(3-amino-1-benzylpyrrolidin-3-yl)methanol

(3-amino-1-benzylpyrrolidin-3-yl)methanol

C12H18N2O (206.1419058)


   

4-(2,6-DIMETHYLMORPHOLINO)ANILINE

4-(2,6-DIMETHYLMORPHOLINO)ANILINE

C12H18N2O (206.1419058)


   

Ibuprofen Impurity 7

Ibuprofen Impurity 7

C13H18O2 (206.1306728)


   

Ibuprofen Impurity 59

Ibuprofen Impurity 59

C13H18O2 (206.1306728)


   

phenethyl pivalate

2-Phenylethyl pivalate

C13H18O2 (206.1306728)


A pivalate ester of 2-phenylethanol.

   

(2S)-2-(4-butylphenyl)propanoic acid

(2S)-2-(4-butylphenyl)propanoic acid

C13H18O2 (206.1306728)


   

Ibuprofen Impurity F

Ibuprofen Impurity F

C13H18O2 (206.1306728)


   

ALPHA-(TERT-BUTYL)HYDROCINNAMIC ACID

ALPHA-(TERT-BUTYL)HYDROCINNAMIC ACID

C13H18O2 (206.1306728)


   
   

2,5-Di-tert-butylphenol

2,5-Di-tert-butylphenol

C14H22O (206.1670562)


A member of the class of phenols that is phenol substituted by tert-butyl groups at position 2 and 5.

   

Piperazine,1-[(4-methoxyphenyl)methyl]-

Piperazine,1-[(4-methoxyphenyl)methyl]-

C12H18N2O (206.1419058)


   

4-PENTYLBENZENE-1-CARBOHYDRAZIDE

4-PENTYLBENZENE-1-CARBOHYDRAZIDE

C12H18N2O (206.1419058)


   

2-MORPHOLIN-4-YL-2-PYRIDIN-2-YLETHANAMINE

2-MORPHOLIN-4-YL-2-PYRIDIN-2-YLETHANAMINE

C12H18N2O (206.1419058)


   

N-Benzyl-N,N-diethylethanaminium tetrahydroborate

N-Benzyl-N,N-diethylethanaminium tetrahydroborate

C13H25BN (206.207994)


   

4-(2-Morpholinoethyl)aniline

4-(2-Morpholinoethyl)aniline

C12H18N2O (206.1419058)


   

3-AMINO-2-FLUORO-4-METHYLPYRIDINE

3-AMINO-2-FLUORO-4-METHYLPYRIDINE

C12H18N2O (206.1419058)


   

(4-BENZYLMORPHOLIN-3-YL)METHANAMINE

(4-BENZYLMORPHOLIN-3-YL)METHANAMINE

C12H18N2O (206.1419058)


   

3-HYDROXY-2,4-DIMETHYL-1-PHENYL-PENTAN-1-ONE

3-HYDROXY-2,4-DIMETHYL-1-PHENYL-PENTAN-1-ONE

C13H18O2 (206.1306728)


   

4-[2-(1-Pyrrolidinyl)ethoxy]aniline

4-[2-(1-Pyrrolidinyl)ethoxy]aniline

C12H18N2O (206.1419058)


   

4-(MORPHOLINOMETHYL)BENZYLAMINE

4-(MORPHOLINOMETHYL)BENZYLAMINE

C12H18N2O (206.1419058)


   

2-methyl-5-(piperidin-3-ylmethoxy)pyridine

2-methyl-5-(piperidin-3-ylmethoxy)pyridine

C12H18N2O (206.1419058)


   

N-(4-Methoxyphenyl)-4-piperidinamine

N-(4-Methoxyphenyl)-4-piperidinamine

C12H18N2O (206.1419058)


   

4-Hexoxybenzaldehyde

4-Hexoxybenzaldehyde

C13H18O2 (206.1306728)


   

4-Hexylbenzoic acid

4-Hexylbenzoic acid

C13H18O2 (206.1306728)


   
   

Phenol, 2-octyl-

Phenol, 2-octyl-

C14H22O (206.1670562)


   
   

2,6,10,10-Tetramethyl-1-oxaspiro(4.5)deca-2,6-dien-8-one

2,6,10,10-Tetramethyl-1-oxaspiro(4.5)deca-2,6-dien-8-one

C13H18O2 (206.1306728)


   

4-(3-hydroxybut-1-en-1-ylidene)-3,5,5-trimethylcyclohex-2-en-1-one

4-(3-hydroxybut-1-en-1-ylidene)-3,5,5-trimethylcyclohex-2-en-1-one

C13H18O2 (206.1306728)


   

(E)-4-(5-ethoxypyridin-3-yl)-N-methylbut-3-en-1-amine

(E)-4-(5-ethoxypyridin-3-yl)-N-methylbut-3-en-1-amine

C12H18N2O (206.1419058)


   
   

2-amino-N-(2,6-dimethylphenyl)butanamide

2-amino-N-(2,6-dimethylphenyl)butanamide

C12H18N2O (206.1419058)


   

4-Methylpentyl benzoate

4-Methylpentyl benzoate

C13H18O2 (206.1306728)


   

Pentyl 4-methylbenzoate

Pentyl 4-methylbenzoate

C13H18O2 (206.1306728)


   

6-Hydroxy-2,2,5,7-tetramethylchroman

6-Hydroxy-2,2,5,7-tetramethylchroman

C13H18O2 (206.1306728)


   

Benzoic acid, 4-pentyl-, methyl ester

Benzoic acid, 4-pentyl-, methyl ester

C13H18O2 (206.1306728)


   

4,8,12-Trioxatridecan-1-ol

4,8,12-Trioxatridecan-1-ol

C10H22O4 (206.1518012)


   

Butanoic acid, 3-methyl-, 1-phenylethyl ester

Butanoic acid, 3-methyl-, 1-phenylethyl ester

C13H18O2 (206.1306728)


   

2,2-Dimethyl-3,6,9-trioxa-2-silaundecane

2,2-Dimethyl-3,6,9-trioxa-2-silaundecane

C9H22O3Si (206.13381420000002)


   

4-Isopropyl-6-methylene-3,4,4a,5,6,7,8,8a-octahydro-1(2H)-naphthalenone

4-Isopropyl-6-methylene-3,4,4a,5,6,7,8,8a-octahydro-1(2H)-naphthalenone

C14H22O (206.1670562)


   

2,6-Dimethyl-3,4-dihydro-2H-1-benzopyran-2-ethanol

2,6-Dimethyl-3,4-dihydro-2H-1-benzopyran-2-ethanol

C13H18O2 (206.1306728)


   

N-Octyl-2-hydroxyethyl sulfoxide

N-Octyl-2-hydroxyethyl sulfoxide

C10H22O2S (206.1340432)


   

29790-29-2

3-[(E)-3-ketobut-1-enyl]-2,4,4-trimethyl-cyclohex-2-en-1-one

C13H18O2 (206.1306728)


   

AI3-26293

InChI=1\C14H22O\c1-13(2,3)10-8-7-9-11(12(10)15)14(4,5)6\h7-9,15H,1-6H

C14H22O (206.1670562)


   

96-76-4

InChI=1\C14H22O\c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6\h7-9,15H,1-6H

C14H22O (206.1670562)


2,4-Di-tert-butylphenol is an endogenous metabolite. 2,4-Di-tert-butylphenol is an endogenous metabolite.

   

AI3-30606

Butanoic acid, 3-methyl-, 2-phenylethyl ester

C13H18O2 (206.1306728)


   

5875-45-6

Phenol, 2,5-bis(1,1-dimethylethyl)-

C14H22O (206.1670562)


   

IDI1_029947

Phenol, 3,5-bis(1,1-dimethylethyl)-

C14H22O (206.1670562)


3,5-Di-tert-butylphenol is an volatile organic compound with anti-biofilm and antifungal activities. 3,5-Di-tert-butylphenol induces accumulation of reactive oxygen species (ROS). 3,5-Di-tert-butylphenol is an volatile organic compound with anti-biofilm and antifungal activities. 3,5-Di-tert-butylphenol induces accumulation of reactive oxygen species (ROS).

   

AI3-02064

4-09-00-00293 (Beilstein Handbook Reference)

C13H18O2 (206.1306728)


   

CHEBI:36534

(6E,10E)-2,6,10-Trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)


   

Caparratriene

Caparratriene

C15H26 (206.2034396)


   

(1S,2S)-1-ethenyl-1-methyl-4-propan-2-yl-2-prop-1-en-2-ylcyclohexane

(1S,2S)-1-ethenyl-1-methyl-4-propan-2-yl-2-prop-1-en-2-ylcyclohexane

C15H26 (206.2034396)


   

(E)-3,7,11-Trimethyl-1,6,10-dodecatriene

(E)-3,7,11-Trimethyl-1,6,10-dodecatriene

C15H26 (206.2034396)


   

alpha-3-Oxo-damascone

alpha-3-Oxo-damascone

C13H18O2 (206.1306728)


   

(4S,4aS,8aR)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,8,8a-octahydronaphthalene

(4S,4aS,8aR)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,8,8a-octahydronaphthalene

C15H26 (206.2034396)


   

Hexan-2-yl benzoate

Hexan-2-yl benzoate

C13H18O2 (206.1306728)


   

Benzoic acid, hex-3-yl ester

Benzoic acid, hex-3-yl ester

C13H18O2 (206.1306728)


   

1-Pyridin-2-yl-heptan-1-one oxime

1-Pyridin-2-yl-heptan-1-one oxime

C12H18N2O (206.1419058)


   
   

9,9,9-Trimethylisoeugenol

9,9,9-Trimethylisoeugenol

C13H18O2 (206.1306728)


A derivative of isoeugenol with three methyl substituents at position 9.

   

N-(D-erythrulosyl)-cadaverine

N-(D-erythrulosyl)-cadaverine

C9H22N2O3+2 (206.1630342)


   

Isolongifolane

Isolongifolane

C15H26 (206.2034396)


   

3,5,6-Trimethyleugenol

3,5,6-Trimethyleugenol

C13H18O2 (206.1306728)


A derivative of eugenol with methyl substituents at ring positions 3, 5 and 6.

   

Pentyl 2-methylbenzoate

Pentyl 2-methylbenzoate

C13H18O2 (206.1306728)


   

p-Toluic acid, 3-methylbutyl ester

p-Toluic acid, 3-methylbutyl ester

C13H18O2 (206.1306728)


   
   

(2R,5S,7S,8R)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane

(2R,5S,7S,8R)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecane

C15H26 (206.2034396)


   

o-Toluic acid, 3-methylbutyl ester

o-Toluic acid, 3-methylbutyl ester

C13H18O2 (206.1306728)


   

Acetic acid 1-benzyl-2-methylpropyl ester

Acetic acid 1-benzyl-2-methylpropyl ester

C13H18O2 (206.1306728)


   

1-Methoxy-1-phenyl-2-methyl-3-pentanone

1-Methoxy-1-phenyl-2-methyl-3-pentanone

C13H18O2 (206.1306728)


   

4-Methyl-3-cyclohexenyl 4-methyl-3-pentenyl ketone

4-Methyl-3-cyclohexenyl 4-methyl-3-pentenyl ketone

C14H22O (206.1670562)


   

3-(4-Butyl-5,5-dimethyl-1,3-cyclopentadienyl)propanal

3-(4-Butyl-5,5-dimethyl-1,3-cyclopentadienyl)propanal

C14H22O (206.1670562)


   

3-Methyl-4-phenylpentanoic acid methyl ester

3-Methyl-4-phenylpentanoic acid methyl ester

C13H18O2 (206.1306728)


   

3,7-Dimethyl-1,2,3,7-octanetetrol

3,7-Dimethyl-1,2,3,7-octanetetrol

C10H22O4 (206.1518012)


   

4-Methylenecyclohexyl 4-methyl-3-pentenyl ketone

4-Methylenecyclohexyl 4-methyl-3-pentenyl ketone

C14H22O (206.1670562)


   

10,11-Dimethylspiro(5.6)dodec-10-EN-7-one

10,11-Dimethylspiro(5.6)dodec-10-EN-7-one

C14H22O (206.1670562)


   

1-Isobutyl-9-methylbicyclo(3.2.2)non-6-EN-2-one

1-Isobutyl-9-methylbicyclo(3.2.2)non-6-EN-2-one

C14H22O (206.1670562)


   

7-Butyl-6,6-dimethylbicyclo(3.3.0)oct-7-EN-2-one

7-Butyl-6,6-dimethylbicyclo(3.3.0)oct-7-EN-2-one

C14H22O (206.1670562)


   

Oxotremorine

Oxotremorine

C12H18N2O (206.1419058)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018679 - Cholinergic Agonists

   

Dexibuprofen

(S)-(+)-Ibuprofen

C13H18O2 (206.1306728)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AE - Propionic acid derivatives C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

4-tert-Octylphenol

4-tert-Octylphenol

C14H22O (206.1670562)


D013501 - Surface-Active Agents 4-tert-Octylphenol, a endocrine-disrupting chemical, is an estrogenic agent. 4-tert-Octylphenol induces apoptosis in neuronal progenitor cells in offspring mouse brain. 4-tert-Octylphenol reduces bromodeoxyuridine (BrdU), mitotic marker Ki67, and phospho-histone H3 (p-Histone-H3), resulting in a reduction of neuronal progenitor proliferation. 4-tert-Octylphenol disrupts brain development and behavior in mice[1].

   

P-Octylphenol

4-N-Octylphenol

C14H22O (206.1670562)


A member of the class of phenols that is phenol which is substituted at the para- position by an octyl group. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens

   

Monoethylglycinexylidide

Monoethylglycinexylidide

C12H18N2O (206.1419058)


Amino acid amide formed from 2,6-dimethylaniline and N-ethylglycine components; an active metabolite of lidocaine, formed by oxidative deethylation. Used as an indicator of hepatic function.

   

beta-Methylionone

1-Penten-3-one,1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

C14H22O (206.1670562)


   

Isoamyl phenylacetate

3-Methylbutyl phenylacetate

C13H18O2 (206.1306728)


   

irone

alpha-Irone

C14H22O (206.1670562)


D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids

   

delta-Iraldeine

3-Buten-2-one,3-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

C14H22O (206.1670562)


   

ethyl 2-benzylbutanoate

ethyl 2-benzylbutanoate

C13H18O2 (206.1306728)


   

delta-methyl ionone

delta-methyl ionone

C14H22O (206.1670562)


   

alpha-methyl phenethyl butyrate

alpha-methyl phenethyl butyrate

C13H18O2 (206.1306728)


   

(6E,10E)-2,6,10-Trimethyldodeca-2,6,10-triene

(6E,10E)-2,6,10-Trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)


   

N-Hydroxy-N-(4-butyl-2-methylphenyl)formamidine

N-Hydroxy-N-(4-butyl-2-methylphenyl)formamidine

C12H18N2O (206.1419058)


   

1-Oxaspiro[4.5]deca-3,6-diene, 2,7-dimethyl-10-(1-methylethyl)-

1-Oxaspiro[4.5]deca-3,6-diene, 2,7-dimethyl-10-(1-methylethyl)-

C14H22O (206.1670562)


   

(Z)-alpha-Irone

(Z)-alpha-Irone

C14H22O (206.1670562)


   

1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane

1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane

C15H26 (206.2034396)


   

Ditert-butylphenol

Ditert-butylphenol

C14H22O (206.1670562)


   

Tetradecatrienal

Tetradecatrienal

C14H22O (206.1670562)


   

1,1,4,7-tetramethyl-decahydrocyclopropa[e]azulene

1,1,4,7-tetramethyl-decahydrocyclopropa[e]azulene

C15H26 (206.2034396)


   

4,4,8-trimethylcycloundeca-2,8-dien-1-one

4,4,8-trimethylcycloundeca-2,8-dien-1-one

C14H22O (206.1670562)


   

tetradeca-9,11,13-trienal

tetradeca-9,11,13-trienal

C14H22O (206.1670562)


   

(8-ethenyl-5-methylidene-octahydro-1h-naphthalen-2-yl)methanol

(8-ethenyl-5-methylidene-octahydro-1h-naphthalen-2-yl)methanol

C14H22O (206.1670562)


   

(4as,8ar)-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carbaldehyde

(4as,8ar)-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carbaldehyde

C14H22O (206.1670562)


   

1-methyl-4-(6-methylheptan-2-ylidene)cyclohex-1-ene

1-methyl-4-(6-methylheptan-2-ylidene)cyclohex-1-ene

C15H26 (206.2034396)


   

(1r,4s,6r,9s)-6,10,10-trimethyl-2-methylidene-5-oxatricyclo[7.2.0.0⁴,⁶]undecane

(1r,4s,6r,9s)-6,10,10-trimethyl-2-methylidene-5-oxatricyclo[7.2.0.0⁴,⁶]undecane

C14H22O (206.1670562)


   

2-isopropyl-4-methyl-1-(2-methylpropoxy)benzene

2-isopropyl-4-methyl-1-(2-methylpropoxy)benzene

C14H22O (206.1670562)


   

1,5,8,8-tetramethylcycloundeca-1,5-diene

1,5,8,8-tetramethylcycloundeca-1,5-diene

C15H26 (206.2034396)


   

3-ethenyl-6-isopropyl-2-(prop-1-en-2-yl)cyclohexan-1-one

3-ethenyl-6-isopropyl-2-(prop-1-en-2-yl)cyclohexan-1-one

C14H22O (206.1670562)


   

(4as,5r,8r)-8-isopropyl-5-methyl-4,4a,5,6,7,8-hexahydro-3h-naphthalen-2-one

(4as,5r,8r)-8-isopropyl-5-methyl-4,4a,5,6,7,8-hexahydro-3h-naphthalen-2-one

C14H22O (206.1670562)


   

(2e,4e,7s)-3,7,11-trimethyldodeca-2,4,10-triene

(2e,4e,7s)-3,7,11-trimethyldodeca-2,4,10-triene

C15H26 (206.2034396)


   

2,6,11-trimethyldodeca-2,6,10-triene

2,6,11-trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)


   

(4as,7s,8as)-7-isopropyl-4a-methyl-1-methylidene-octahydronaphthalene

(4as,7s,8as)-7-isopropyl-4a-methyl-1-methylidene-octahydronaphthalene

C15H26 (206.2034396)


   

4-methyl-1-[(3e)-6-methylhept-3-en-2-yl]cyclohex-1-ene

4-methyl-1-[(3e)-6-methylhept-3-en-2-yl]cyclohex-1-ene

C15H26 (206.2034396)


   

4a,8,8-trimethyl-hexahydro-1h-cyclopropa[e]naphthalen-2-one

4a,8,8-trimethyl-hexahydro-1h-cyclopropa[e]naphthalen-2-one

C14H22O (206.1670562)


   

(1r,2s,5r,8r)-2,6,6,8-tetramethyltricyclo[6.3.0.0¹,⁵]undecane

(1r,2s,5r,8r)-2,6,6,8-tetramethyltricyclo[6.3.0.0¹,⁵]undecane

C15H26 (206.2034396)


   

(4ar,7r,8as)-7-isopropyl-4a-methyl-1-methylidene-octahydronaphthalene

(4ar,7r,8as)-7-isopropyl-4a-methyl-1-methylidene-octahydronaphthalene

C15H26 (206.2034396)


   

(6e)-2,6,11-trimethyldodeca-2,6,10-triene

(6e)-2,6,11-trimethyldodeca-2,6,10-triene

C15H26 (206.2034396)