Exact Mass: 210.1116704
Exact Mass Matches: 210.1116704
Found 500 metabolites which its exact mass value is equals to given mass value 210.1116704,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Jasmonic acid
Jasmonic acid is an oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring. It has a role as a plant metabolite and a member of jasmonates. It is a conjugate acid of a jasmonate(1-). It is an enantiomer of a (+)-jasmonic acid. Jasmonic acid is a natural product found in Ficus superba, Cleyera japonica, and other organisms with data available. Jasmonic acid is found in apple. Esters are present in Jasminum grandiflorum (royal jasmine) and are responsible for its odour. Jasmonic acid is a member of the jasmonate class of plant hormones. It is biosynthesized from linolenic acid by the octadecanoid pathway An oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring. Esters are present in Jasminum grandiflorum (royal jasmine) and are responsible for its odour [DFC] D006133 - Growth Substances > D010937 - Plant Growth Regulators
Aprobarbital
Aprobarbital is a barbiturate derivative synthesized in the 1920s by Ernst Preiswerk. It has sedative, hypnotic and anticonvulsant properties, and was used primarily for the treatment of insomnia. Aprobarbital was never as widely used as more common barbiturate derivatives such as phenobarbital and is now rarely prescribed. N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
Lactaroviolin
Lactaroviolin is found in mushrooms. Lactaroviolin is a constituent of mushroom Lactarius deliciosus Constituent of mushroom Lactarius deliciosus. Lactaroviolin is found in mushrooms.
7-Epijasmonic acid
7-epijasmonic acid, also known as (+)-epijasmonate, is a member of the class of compounds known as jasmonic acids. Jasmonic acids are lipids containing or derived from a jasmonic acid, with a structure characterized by the presence of an alkene chain linked to a 2-(3-oxocyclopentyl)acetic acid moiety. Thus, 7-epijasmonic acid is considered to be an octadecanoid lipid molecule. 7-epijasmonic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). 7-epijasmonic acid can be found in a number of food items such as broad bean, flaxseed, corn, and eggplant, which makes 7-epijasmonic acid a potential biomarker for the consumption of these food products.
4-(Butoxymethyl)-2-methoxyphenol
Vanillyl butyl ether is an ether of monohydroxybenzoic acid. It is added to food products as a flavoring agent. It is also present in cosmetics and personal care products as a fragrance ingredient, oral care agent, hair conditioning agent, and warming or cooling agent. 4-(Butoxymethyl)-2-methoxyphenol is a cooling agent used in confectionery etc. Cooling agent used in confectionery etc. Vanillyl butyl ether is a major contributor to the characteristic flavor and fragrance of vanilla. Vanillyl butyl ether is one of the eco-friendly and nontoxic substances. Vanillyl butyl ether has been proposed as a mild warming agent providing a warming sensation and enhancing the blood circulation[1].
1,3-Diphenyl-2-propanone
1,3-Diphenyl-2-propanone is a flavouring agent Flavouring agent
1,3-Diphenyl-1-propanone
1,3-Diphenyl-1-propanone is found in mushrooms. 1,3-Diphenyl-1-propanone is isolated from Phallus impudicus (common stinkhorn
(R)-8-Acetoxycarvotanacetone
(R)-8-Acetoxycarvotanacetone is found in herbs and spices. (R)-8-Acetoxycarvotanacetone is a constituent of cardamom oil. Constituent of cardamom oil. (R)-8-Acetoxycarvotanacetone is found in herbs and spices.
Sedanonic acid
Sedanonic acid is found in green vegetables. Sedanonic acid is isolated from celery oil (Apium graveolens) after hydrolysis. Isolated from celery oil (Apium graveolens) after hydrolysis Sedanonic acid is found in green vegetables.
Naphazoline
Naphazoline is only found in individuals that have used or taken this drug. It is a rapid acting sympathomimetic vasoconstrictor of occular artierioles. It acts to decrease congestion of the conjunctiva and is found in many over-the-counter eye drops.Naphazoline is a direct acting sympathomimetic drug, which acts on alpha-adrenergic receptors in the arterioles of the nasal mucosa. This activates the adrenal system to yield systemic vasoconstrction. In producing vasoconstriction, the result is a decrease in blood flow in the nasal passages and consequently decreased nasal congestion. The vasoconstriction means that there is less pressure in the capillaries and less water can filter out, thus less discharge is made. R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AB - Sympathomimetics, combinations excl. corticosteroids R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AA - Sympathomimetics, plain S - Sensory organs > S01 - Ophthalmologicals > S01G - Decongestants and antiallergics > S01GA - Sympathomimetics used as decongestants C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
3-Ethenyl-2,5-dimethyl-4-oxohex-5-en-2-yl acetate
3-Ethenyl-2,5-dimethyl-4-oxohex-5-en-2-yl acetate is a constituent of Artemisia vulgaris (mugwort). Constituent of Artemisia vulgaris (mugwort)
Dihydro-3-(2-octenyl)-2,5-furandione
Dihydro-3-(2-octenyl)-2,5-furandione is a reactant for manufacture of octenylsuccinoyl starches, which are used as emulsifiers in foods and pharmaceutical products. Reactant for manuf. of octenylsuccinoyl starches, which are used as emulsifiers in foods and pharmaceutical products.
2-Ethyl-1-hexanol sulfate
2-Ethyl-1-hexanol sulfate is used as a food additive.
1-Benzyloxy-1-(2-methoxyethoxy)ethane
1-Benzyloxy-1-(2-methoxyethoxy)ethane is a flavouring ingredient. Flavouring ingredient
Isoamyl 2-furonpropionate
Isoamyl 2-furonpropionate is a flavouring ingredient. Flavouring ingredient
Dihydro-3-(1-octenyl)-2,5-furandione
Starch modifier (esterification agent) for use in beverages and beverage bases as a stabiliser or emulsifier. Starch modifier (esterification agent) for use in beverages and beverage bases as a stabiliser or emulsifier
4-(1-Cyanoethyl)-1,2,3,4-tetrahydronaphthalene-1-carbonitrile
Etimizol
D002491 - Central Nervous System Agents > D018697 - Nootropic Agents
Dihydrochalcone
A member of the class of dihydrochalcones that is acetophenone in which one of the hydrogens of the methyl group is replaced by a benzyl group. CASMI2013 Challenge_4 MS2 data; [MS1] MSJ00007 CASMI2013 Challenge_4 MS1 data; [MS2] MSJ00008
2,6,6-trimethyl-4-oxo-2-cyclohexene-1-acetic acid methyl ester
4-oxogeranyl acetate|Ac-(E)-1-Hydroxy-3,7-dimethyl-2,6-octadien-4-one
1beta,4beta-dihydroxy-11,12,13-trinor-8,9-eudesmen-7-one
rel-(2R,3R,7R,7aR)-2,3,7,7a-tetrahydro-3-hydroxy-7-methyl-2-[(1E)-prop-1-en-1-yl]-5H-furo[3,4-b]pyran-5-one|theissenolactone B
(5R,6S)-6-[(2E)-but-2-en-2-yl]-3,3,5-trimethyltdihydro-2H-pyran-2,4(3H)-dione|helicascolide C
(S)-7-ethyl-4-methoxy-7,8-dihydropyrano[4,3-b]pyran-2(5H)-one|pyrenocine J
2,5-dimethyl-5-vinylhexahydro-2,2-bifuran-5(2h)-one
2-Hydroxypropionic acid 2-(p-hydroxyphenyl)ethyl ester
octyl hydrogen sulfate
An alkyl sulfate that is the sulfuric ester of octan-1-ol.
3-allyl-3a,5,6,6a-tetrahydro-2,4,6a-trihydroxy-4H-pentalen-1-one|xialenon B
Flavan
The simplest member of the class of flavans that is chromane substituted by a phenyl group at position 2.
(2Xi,8R)-2-Aethyl-8-methyl-3,4-dihydro-2H,8H-furo[3,4-b]oxepin-5,6-dion|(2Xi,8R)-2-ethyl-8-methyl-3,4-dihydro-2H,8H-furo[3,4-b]oxepin-5,6-dione|2-ethyl-8-methyl-3,4-dihydro-2H,8H-furo[3,4-b]oxepine-5,6-dione|Terrestrinsaeure
(1S:2Xi)-3-Oxo-2,4,7,7-tetramethyl-norbornan-carbonsaeure-(2)|(1S:2Xi)-3-oxo-2,4,7,7-tetramethyl-norbornane-carboxylic acid-(2)
(3R*,4R*,6S*)-3-acetoxy-6-hydroxy-p-mentha-1,8-diene
3,4-Dihydro-5-hydroxy-3,4-dimethyl-1,2-bi[1H-pyrrole]-2,5(2H,5H)-dione
1-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-1-methylurea
2,4-dihydroxy-6-methoxyl-methylene-3-methyl-acetophenone
3-(2,5-Dimethoxyphenyl)propanoic acid
A monocarboxylic acid that is 3-phenylpropionic acid in which the hydrogens at positions 2 and 5 of the phenyl ring are replaced by methoxy groups.
Ethyl everninate
2-hydroxy-4-methoxy-6-methylbenzoic acid ethyl ester is a methoxybenzoic acid. Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, ethyl ester is a natural product found in Evernia prunastri with data available.
Jasmonic acid
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.911 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.912 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.909 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.910
4,7,7-Trimethyl-2,3-dioxo-bicyclo[2.2.1]heptane-1-carboxylic acid
3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one
APROBARBITAL
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
sinapyl alcohol
A primary alcohol, being cinnamyl alcohol hydroxylated at C-4 and methoxylated at C-3 and -5. Sinapyl alcohol, also known as 4-(3-hydroxy-1-propenyl)-2,6-dimethoxy-phenol or 4-hydroxy-3,5-dimethoxycinnamyl alcohol, is a member of the class of compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Sinapyl alcohol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Sinapyl alcohol can be found in a number of food items such as ginseng, endive, sea-buckthornberry, and white cabbage, which makes sinapyl alcohol a potential biomarker for the consumption of these food products. Sinapyl alcohol is an organic compound structurally related to cinnamic acid. It is biosynthetized via the phenylpropanoid biochemical pathway, its immediate precursor being sinapaldehyde. This phytochemical is one of the monolignols, which are precursor to lignin or lignans. It is also a biosynthetic precursor to various stilbenoids and coumarins .
naphazoline
R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AB - Sympathomimetics, combinations excl. corticosteroids R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AA - Sympathomimetics, plain S - Sensory organs > S01 - Ophthalmologicals > S01G - Decongestants and antiallergics > S01GA - Sympathomimetics used as decongestants C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
3-Amino-9-ethylcarbazole
CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7312; ORIGINAL_PRECURSOR_SCAN_NO 7310 CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7362; ORIGINAL_PRECURSOR_SCAN_NO 7359 CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7331; ORIGINAL_PRECURSOR_SCAN_NO 7328 CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7358; ORIGINAL_PRECURSOR_SCAN_NO 7356 CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7361; ORIGINAL_PRECURSOR_SCAN_NO 7357 CONFIDENCE standard compound; INTERNAL_ID 809; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7367; ORIGINAL_PRECURSOR_SCAN_NO 7362
(±)-Jasmonic acid
Butyl vanillyl ether
Vanillyl butyl ether is a major contributor to the characteristic flavor and fragrance of vanilla. Vanillyl butyl ether is one of the eco-friendly and nontoxic substances. Vanillyl butyl ether has been proposed as a mild warming agent providing a warming sensation and enhancing the blood circulation[1].
Bancroftinone
Bancroftinone, a natural product, belongs to the class of alkyl-phenylketones[1]. Bancroftinone, a natural product, belongs to the class of alkyl-phenylketones[1].
Ieodomycin B
A natural product found in Bacillus species.
(5-fluoro-2-morpholin-4-ylphenyl)methanamine
C11H15FN2O (210.11683519999997)
(S)-3-(1-Amino-2-Methylpropyl)benzonitrile hydrochloride
(R)-3-(1-Amino-2-Methylpropyl)benzonitrile hydrochloride
5-Hydroxydecanoate sodium
5-Hydroxydecanoate sodium is a selective ATP-sensitive K+ (KATP) channel blocker (IC50 of ~30 μM). 5-Hydroxydecanoate sodium is a substrate for mitochondrial outer membrane acyl-CoA synthetase and has antioxidant activity[1][2].
(S)-2-(1-Amino-2-Methylpropyl)benzonitrile hydrochloride
4-((1R)-1-AMINO-2-METHYLPROPYL)BENZENECARBONITRILE-HCl
BOC-1-AMINO-1,2,3,4-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID
1-Benzyl-2-(difluoromethyl)-4,5-dihydro-1H-imidazole
C11H12F2N2 (210.09684959999998)
(2Z)-3-(2-FURYL)-2-(5-PHENYL-1H-TETRAZOL-1-YL)ACRYLICACID
(S)-2,2,4,6,6-PENTAMETHYL-7,7A-DIHYDROBENZO[D][1,3]DIOXOL-5(6H)-ONE
N-[2-amino-1-(3,4-dimethoxyphenyl)ethylidene]hydroxylamine
Dimethyl carbate
P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03B - Insecticides and repellents
6-TERT-BUTYL-4,5,6,7-TETRAHYDRO-BENZOTHIAZOL-2-YLAMINE HYDROCHLORIDE
3-(4-HYDROXY-3,5-DIMETHOXY-PHENYL)-PROPIONALDEHYDE
N-[2-amino-1-(2,4-dimethoxyphenyl)ethylidene]hydroxylamine
1-(2-METHYL-2,3-DIHYDRO-BENZOFURAN-5-YL)-ETHYLAMINE
1H-Indole,2,3-dihydro-7-methyl-2-(2-pyridinyl)-(9CI)
ethyl 2-methoxy-4,6-dimethylpyrimidine-5-carboxylate
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(2-buten-1-yl)-5-ethyl-
N-methyl-1-(5-piperidin-1-ylthiophen-2-yl)methanamine
2-Cyclohexene-1-carboxylicacid, 6-ethyl-2-methyl-4-oxo-, ethyl ester
2-(7-methyl-1h-indol-3-yl)ethylamine hydrochloride
3-(1,3-dihydro-2H-isoindol-2-yl)aniline(SALTDATA: FREE)
5-Amino-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole-4-carboxamide
1,3-Benzodioxol-5(6H)-one, 7,7a-dihydro-2,2,4,6,6-pentamethyl-
(1R,4R)-N1-(5-Fluoro-pyriMidin-2-yl)-cyclohexane-1,4-diaMine
C10H15FN4 (210.12806819999997)
1-(2-CHLOROBENZYL)-5-OXOPYRROLIDINE-3-CARBOXYLICACID
2-Cyclohexene-1-carboxylicacid, 3-ethyl-2-methyl-4-oxo-, ethyl ester
1-(4,4,4-TRIFLUORO-3-OXO-BUT-1-ENYL)-PYRROLIDINE-2-CARBOXYLICACID
1-(4-fluoro-2-methoxyphenyl)piperazine
C11H15FN2O (210.11683519999997)
2-(2-methyl-1H-indol-3-yl)ethanamine hydrochloride
2,2,2-trifluoro-N-(piperidin-4-ylmethyl)acetamide
C8H13F3N2O (210.09799239999998)
Carbamic acid, N-(3-hydroxy-2-pyridinyl)-, 1,1-dimethylethyl ester
6-amino-5-(morpholin-4-ylmethyl)-1H-pyrimidin-2-one
(S)-tert-Butyl (2-aminopropyl)carbamate hydrochloride
Neoflavan
The simplest member of the class of neoflavans, that is 3,4-dihydro-2H-1-benzopyran substituted by a phenyl group at position 4.
(2E,6E)-3,7-Dimethyl-8-oxoocta-2,6-dien-1-YL acetate
2-(3-cyano-4,5,6-trimethyl-1H-pyridin-2-ylidene)propanedinitrile
[2-(3,4-Dihydroxyphenyl)-2-oxoethyl]-trimethylammonium
methyl N-[1-(diethylamino)ethylidene]phosphoramidofluoridate
2,5-Dimethylbenzenethiol, TMS derivative
C11H18SSi (210.08984279999999)
3,5-Dimethylthiophenol, S-trimethylsilyl-
C11H18SSi (210.08984279999999)
2,4-Dimethylbenzenethiol, TMS derivative
C11H18SSi (210.08984279999999)
2,6-Dimethylbenzenethiol, TMS derivative
C11H18SSi (210.08984279999999)
Methyl 3,4,4abeta,5,6,7,8,8abeta-octahydronaphthalen-1(2H)-oxo-4alpha-carboxylate
Methyl 4,4-dimethyl-8-oxo-1alpha,5alpha-bicyclo(3.3.0)octane-2alpha-carboxylate
Methyl 4,4-dimethyl-8-oxo-1alpha,5alpha-bicyclo(3.3.0)octane-2beta-carboxylate
1-(Tetrahydro-2H-pyran-4-yl)-3-cyclohexene-1-carboxylic acid
2,6-Dimethyl-6-(1,3-dioxolan-2-yl)-1-cyclohexene-1-carbaldehyde
Methyl 4(3H)-oxo-1,2,4aalpha,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylate
(+)-7-Isojasmonic acid
An oxylipin that is [(1S)-3-oxocyclopentyl]acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 on the cyclopentanone ring.
Isoflavan
The simplest member of the class of isoflavans that is chromane substituted by a phenyl substituent at position 3.
2-ethylhexyl sulfate
An alkyl sulfate that is the mono(2-ethylhexyl) ester of sulfuric acid.
3-[(3-aminopropyl)amino]-4-hydroxybenzoic acid
A monohydroxybenzoic acid that is 3-amino-4-hydroxybenzoic acid in which one of the hydrogens attached to the amino group has been replaced by a 3-aminopropyl group. Derivative of aminohydroxybenzoic acid, a novel and abundant metabolite found in Acinetobacter baylyi ADP1 grown on quinate carbon source.