Exact Mass: 198.1045

Exact Mass Matches: 198.1045

Found 119 metabolites which its exact mass value is equals to given mass value 198.1045, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

4-Phenethylphenol

4-(2-Phenylethyl)phenol

C14H14O (198.1045)


   

Metharbital

5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione

C9H14N2O3 (198.1004)


Metharbital is only found in individuals that have used or taken this drug. It was patented in 1905 by Emil Fischer working for Merck. It was marketed as Gemonil by Abbott Laboratories. It is a barbiturate anticonvulsant, used in the treatment of epilepsy. It has similar properties to phenobarbital. Metharbital binds at a distinct binding site associated with a Cl- ionopore at the GABAA receptor, increasing the duration of time for which the Cl- ionopore is open. The post-synaptic inhibitory effect of GABA in the thalamus is, therefore, prolonged. All of these effects are associated with marked decreases in GABA-sensitive neuronal calcium conductance (gCa). The net result of barbiturate action is acute potentiation of inhibitory GABAergic tone. Barbiturates also act through potent (if less well characterized) and direct inhibition of excitatory AMPA-type glutamate receptors, resulting in a profound suppression of glutamatergic neurotransmission. N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AA - Barbiturates and derivatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate

   

Dibenzyl ether

1,1-[Oxybis(methylene)]bisbenzene, 9ci

C14H14O (198.1045)


Dibenzyl ether, also known as benzyl oxide or fema 2371, belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR (R = alkyl, aryl; R=benzene). Dibenzyl ether is a sweet, almond, and cherry tasting compound. Dibenzyl ether has been detected, but not quantified, in dills. This could make dibenzyl ether a potential biomarker for the consumption of these foods. Flavouring ingredient. Dibenzyl ether is found in dill.

   

1-[2-Methyl-3-(methylthio) allyl]cyclohex-2-enol

1-[(2E)-2-methyl-3-(methylsulfanyl)prop-2-en-1-yl]cyclohex-2-en-1-ol

C11H18OS (198.1078)


1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol is classified as a member of the tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). 1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol is considered to be a practically insoluble (in water) and a very weak acidic compound. 1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol can be found in feces.

   

Chamaviolin

7-ethyl-4-methylazulene-1-carbaldehyde

C14H14O (198.1045)


Chamaviolin is a member of the class of compounds known as guaianes. Guaianes are sesquiterpenoids with a structure based on the guaiane skeleton. Guaiane is a bicyclic compound consisting of a decahydroazulene moiety, substituted with two methyl groups and a 1-methylethyl group at the 1-, 4-, and 7-position, respectively. Chamaviolin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Chamaviolin can be found in german camomile, which makes chamaviolin a potential biomarker for the consumption of this food product.

   

4-(3-methylpyrazin-2-yl)butane-1,2,3-triol

4-(3-methylpyrazin-2-yl)butane-1,2,3-triol

C9H14N2O3 (198.1004)


   

3-Hydroxybibenzyl

3-PHENETHYL-PHENOL

C14H14O (198.1045)


   

SCHEMBL14952777

SCHEMBL14952777

C9H14N2O3 (198.1004)


   

DTXSID401017806

DTXSID401017806

C8H14N4O2 (198.1117)


   

(E)-form-6-Tetradecene-8,10,12-triyn-3-one|6-Tetradecene-8,10,12-triyn-3-one|Artemisiaketon|Tetradec-6t-en-8,10,12-triin-3-on|tetradec-6t-ene-8,10,12-triyn-3-one|trans-Tetradecen-(8)-triin-(2.4.6)-on-(12)

(E)-form-6-Tetradecene-8,10,12-triyn-3-one|6-Tetradecene-8,10,12-triyn-3-one|Artemisiaketon|Tetradec-6t-en-8,10,12-triin-3-on|tetradec-6t-ene-8,10,12-triyn-3-one|trans-Tetradecen-(8)-triin-(2.4.6)-on-(12)

C14H14O (198.1045)


   

9-(1,1-dimethylprop-2-enyloxy)non-trans-7-ene-1,3,5-triyne

9-(1,1-dimethylprop-2-enyloxy)non-trans-7-ene-1,3,5-triyne

C14H14O (198.1045)


   

4,6-Tetradecadiene-8,10,12-triyn-1-ol|all-trans-1-Hydroxy-tetradecadien-(4.6)-triin-(8.10.12)|tetradeca-4,6-dien-8,10,12-triyne-1-ol|tetradeca-4,6-diene-8,10,12-triyn-1-ol|tetradeca-4t,6t-diene-8,10,12-triyn-1-ol

4,6-Tetradecadiene-8,10,12-triyn-1-ol|all-trans-1-Hydroxy-tetradecadien-(4.6)-triin-(8.10.12)|tetradeca-4,6-dien-8,10,12-triyne-1-ol|tetradeca-4,6-diene-8,10,12-triyn-1-ol|tetradeca-4t,6t-diene-8,10,12-triyn-1-ol

C14H14O (198.1045)


   

PROBARBITAL

PROBARBITAL

C9H14N2O3 (198.1004)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives

   

1,4-Dimethyl-7-acetylazulene

1,4-Dimethyl-7-acetylazulene

C14H14O (198.1045)


   

1-Azulenecarboxaldehyde, 7-ethyl-4-methyl-

1-Azulenecarboxaldehyde, 7-ethyl-4-methyl-

C14H14O (198.1045)


   

3-phenethylphenol

3-phenethylphenol

C14H14O (198.1045)


   

C9H14N2O3_(3S,8aS)-3-[(1R)-1-Hydroxyethyl]hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

NCGC00380778-01_C9H14N2O3_(3S,8aS)-3-[(1R)-1-Hydroxyethyl]hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

C9H14N2O3 (198.1004)


   

Terbuthylazine-TP CSCD648241 (LM6)

Terbuthylazine-TP CSCD648241 (LM6)

C8H14N4O2 (198.1117)


CONFIDENCE standard compound; UCHEM_ID 4175

   

o-Methylbenzhydrol

o-Methylbenzhydrol

C14H14O (198.1045)


   

metharbital

5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione

C9H14N2O3 (198.1004)


N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AA - Barbiturates and derivatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate

   

Benzyl oxide

1,1'-[Oxybis(methylene)]bisbenzene, 9CI

C14H14O (198.1045)


   

2-(2-naphthalen-1-ylethyl)oxirane

2-(2-naphthalen-1-ylethyl)oxirane

C14H14O (198.1045)


   

2-Methyl-6-propionylnaphthalene

2-Methyl-6-propionylnaphthalene

C14H14O (198.1045)


   

2,2-Diphenylethanol

2,2-Diphenylethanol

C14H14O (198.1045)


   

4-amino-l-phenylalanine hydrate

4-amino-l-phenylalanine hydrate

C9H14N2O3 (198.1004)


   

1-(3,4-Difluorophenyl)piperazine

1-(3,4-Difluorophenyl)piperazine

C10H12F2N2 (198.0968)


   

(4-METHYL-2-THIENYL)METHYLAMINE

(4-METHYL-2-THIENYL)METHYLAMINE

C14H14O (198.1045)


   

1-(2,4-Difluorophenyl)piperazine

1-(2,4-Difluorophenyl)piperazine

C10H12F2N2 (198.0968)


   

4-(PIPERIDIN-1-YLMETHYL)THIAZOL-2-AMINE

4-(PIPERIDIN-1-YLMETHYL)THIAZOL-2-AMINE

C9H16N3S (198.1065)


   

3-Ethyl-1-oxa-3,7-diazaspiro[4.5]decane-2,4-dione

3-Ethyl-1-oxa-3,7-diazaspiro[4.5]decane-2,4-dione

C9H14N2O3 (198.1004)


   

3-Hydroxymethyl-2-methylbiphenyl

3-Hydroxymethyl-2-methylbiphenyl

C14H14O (198.1045)


   

1-Ethyl-3-methylimidazolium tetrafluoroborate

1-Ethyl-3-methylimidazolium tetrafluoroborate

C6H11BF4N2 (198.0951)


   

4-Methoxydiphenylmethane

4-Methoxydiphenylmethane

C14H14O (198.1045)


   

1-methoxy-4-(4-methylphenyl)benzene

1-methoxy-4-(4-methylphenyl)benzene

C14H14O (198.1045)


   

(4-methylbiphenyl-4-yl)-methanol

(4-methylbiphenyl-4-yl)-methanol

C14H14O (198.1045)


   

4-TRIMETHYLSILANYLOXY-CYCLOHEX-3-ENE-CARBALDEHYDE

4-TRIMETHYLSILANYLOXY-CYCLOHEX-3-ENE-CARBALDEHYDE

C10H18O2Si (198.1076)


   

Methyl 2-amino-5-isobutyloxazole-4-carboxylate

Methyl 2-amino-5-isobutyloxazole-4-carboxylate

C9H14N2O3 (198.1004)


   

2-[1,1-Biphenyl]-4-Yl-1-Ethanol

2-[1,1-Biphenyl]-4-Yl-1-Ethanol

C14H14O (198.1045)


   

5-NORBORNENE-2-BENZOYL

5-NORBORNENE-2-BENZOYL

C14H14O (198.1045)


   

1,3-Diethyl-5,6-diaminouracil

1,3-Diethyl-5,6-diaminouracil

C8H14N4O2 (198.1117)


   

4-Ethylbiphenyl-4-ol

4-Ethylbiphenyl-4-ol

C14H14O (198.1045)


   

5-heptylfuran-2-thiol

5-heptylfuran-2-thiol

C11H18OS (198.1078)


   

1-methyl-2-phenylmethoxy-benzene

1-methyl-2-phenylmethoxy-benzene

C14H14O (198.1045)


   

2-(2-Oxo-1-imidazolidinyl)ethyl methacrylate

2-(2-Oxo-1-imidazolidinyl)ethyl methacrylate

C9H14N2O3 (198.1004)


   

n-benzoylglycine-2,2-d2

n-benzoylglycine-2,2-d2

C9H10D2N2O3 (198.0973)


   

3,4-dimethyldiphenyl ether

3,4-dimethyldiphenyl ether

C14H14O (198.1045)


   

TERT-BUTYL 4-(HYDROXYMETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE

TERT-BUTYL 4-(HYDROXYMETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE

C9H14N2O3 (198.1004)


   

1-Boc-4-(hydroxyMethyl)pyrazole

1-Boc-4-(hydroxyMethyl)pyrazole

C9H14N2O3 (198.1004)


   

ethyl 3-tert-butyl-1,2,4-oxadiazole-5-carboxylate

ethyl 3-tert-butyl-1,2,4-oxadiazole-5-carboxylate

C9H14N2O3 (198.1004)


   

1,1-DIPHENYLETHANOL

1,1-DIPHENYLETHANOL

C14H14O (198.1045)


   

4-[(5-oxo-2-pyrrolidinyl)carbonyl]morpholine

4-[(5-oxo-2-pyrrolidinyl)carbonyl]morpholine

C9H14N2O3 (198.1004)


   

2-(2-Methylphenyl)-benzenemethanol

2-(2-Methylphenyl)-benzenemethanol

C14H14O (198.1045)


   

bis(4-methylphenyl) ether

bis(4-methylphenyl) ether

C14H14O (198.1045)


   

(2-methylbiphenyl-4-yl)-methanol

(2-methylbiphenyl-4-yl)-methanol

C14H14O (198.1045)


   

3,4-DIMETHYL[1,1-BIPHENYL]-4-OL

3,4-DIMETHYL[1,1-BIPHENYL]-4-OL

C14H14O (198.1045)


   

3,4,5-TRIMETHOXY-PHENYL-HYDRAZINE

3,4,5-TRIMETHOXY-PHENYL-HYDRAZINE

C9H14N2O3 (198.1004)


   

2-({6-[(2-HYDROXYETHYL)AMINO]PYRIDAZIN-3-YL}AMINO)ETHAN-1-OL

2-({6-[(2-HYDROXYETHYL)AMINO]PYRIDAZIN-3-YL}AMINO)ETHAN-1-OL

C8H14N4O2 (198.1117)


   

1-Cyclopentene-1-carboxylicacid,2-(2-acetylhydrazino)-,methylester(9CI)

1-Cyclopentene-1-carboxylicacid,2-(2-acetylhydrazino)-,methylester(9CI)

C9H14N2O3 (198.1004)


   

1-(3,5-Difluorophenyl)piperazine

1-(3,5-Difluorophenyl)piperazine

C10H12F2N2 (198.0968)


   

ethyl 2-[3-(1-aminoethyl)-1H-1,2,4-triazol-5-yl]acetate

ethyl 2-[3-(1-aminoethyl)-1H-1,2,4-triazol-5-yl]acetate

C8H14N4O2 (198.1117)


   

1-ADAMANTYLOXYCARBONYL FLUORIDE

1-ADAMANTYLOXYCARBONYL FLUORIDE

C11H15FO2 (198.1056)


   

Phenol,4-methyl-2-(phenylmethyl)-

Phenol,4-methyl-2-(phenylmethyl)-

C14H14O (198.1045)


   

(3-METHYL-[1,1-BIPHENYL]-4-YL)METHANOL

(3-METHYL-[1,1-BIPHENYL]-4-YL)METHANOL

C14H14O (198.1045)


   

(3-METHYL-[1,1-BIPHENYL]-3-YL)METHANOL

(3-METHYL-[1,1-BIPHENYL]-3-YL)METHANOL

C14H14O (198.1045)


   

6-amino-1-methyl-5-(propylamino)pyrimidine-2,4-dione

6-amino-1-methyl-5-(propylamino)pyrimidine-2,4-dione

C8H14N4O2 (198.1117)


   

(2-Methyl-6-quinolinyl)methanol

(2-Methyl-6-quinolinyl)methanol

C14H14O (198.1045)


   

tert-butyl (5-methylisoxazol-3-yl)carbamate

tert-butyl (5-methylisoxazol-3-yl)carbamate

C9H14N2O3 (198.1004)


   

Maleic acid, mono(4-methylpiperazide)

Maleic acid, mono(4-methylpiperazide)

C9H14N2O3 (198.1004)


   

(4-ISOPROPOXYPHENYL)BORONIC ACID HYDRATE

(4-ISOPROPOXYPHENYL)BORONIC ACID HYDRATE

C9H15BO4 (198.1063)


   

3-Methoxy-4-methylbiphenyl

3-Methoxy-4-methylbiphenyl

C14H14O (198.1045)


   

2-(dimethylamino)ethyl 4-amino-1H-imidazole-5-carboxylate

2-(dimethylamino)ethyl 4-amino-1H-imidazole-5-carboxylate

C8H14N4O2 (198.1117)


   

2-ethyl-6-phenylphenol

2-ethyl-6-phenylphenol

C14H14O (198.1045)


   

1-methoxy-4-(2-methylphenyl)benzene

1-methoxy-4-(2-methylphenyl)benzene

C14H14O (198.1045)


   

Ethyl 1-(ethoxymethyl)-1H-imidazole-4-carboxylate

Ethyl 1-(ethoxymethyl)-1H-imidazole-4-carboxylate

C9H14N2O3 (198.1004)


   

4,4-DIMETHYLDIPHENYLETHER

4,4-DIMETHYLDIPHENYLETHER

C14H14O (198.1045)


   

4-Methylbenzhydrol

4-Methylbenzhydrol

C14H14O (198.1045)


   

(R)-(-)-1,2-Diphenylethanol

(R)-(-)-1,2-Diphenylethanol

C14H14O (198.1045)


   

3-Indolizinecarboxylicacid,6-aminooctahydro-5-oxo-(9CI)

3-Indolizinecarboxylicacid,6-aminooctahydro-5-oxo-(9CI)

C9H14N2O3 (198.1004)


   

cis-8-Methoxy-1,3-diazaspiro[4.5]decane-2,4-dione

cis-8-Methoxy-1,3-diazaspiro[4.5]decane-2,4-dione

C9H14N2O3 (198.1004)


   

4-METHOXY-3-METHYLBIPHENYL

4-METHOXY-3-METHYLBIPHENYL

C14H14O (198.1045)


   

2-benzylbenzyl alcohol

2-benzylbenzyl alcohol

C14H14O (198.1045)


   

UNII:4G5CEI3415

4-(1-Phenylethyl)phenol

C14H14O (198.1045)


   

Phenethoxybenzene

Phenethoxybenzene

C14H14O (198.1045)


   

2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylbutyl)-

2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylbutyl)-

C9H14N2O3 (198.1004)


   

1-(4-biphenylyl)ethanol

1-(4-biphenylyl)ethanol

C14H14O (198.1045)


   

ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate

ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate

C9H14N2O3 (198.1004)


   

Mebicar

Mebicar

C8H14N4O2 (198.1117)


D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics C78272 - Agent Affecting Nervous System Tetramethylglycerol (Tetramethylglycoluril) is a small molecule that acts on GABA Receptor, with anti-anxiety activity[1].

   

Cyclo(-Pro-Thr)

Cyclo(-Pro-Thr)

C9H14N2O3 (198.1004)


   

1,2-Diphenylethanol

1,2-Diphenylethanol

C14H14O (198.1045)


   

4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one

4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one

C8H14N4O2 (198.1117)


   

1-Ethyl-3-phenoxybenzene

1-Ethyl-3-phenoxybenzene

C14H14O (198.1045)


   

Trimethylsilyl cyclohex-3-ene-1-carboxylate

Trimethylsilyl cyclohex-3-ene-1-carboxylate

C10H18O2Si (198.1076)


   

LS-363

InChI=1\C14H14O\c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14\h1-10H,11-12H

C14H14O (198.1045)


   

1-[2-Methyl-3-(methylthio) allyl]cyclohex-2-enol

1-[(2E)-2-methyl-3-(methylsulfanyl)prop-2-en-1-yl]cyclohex-2-en-1-ol

C11H18OS (198.1078)


1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol is classified as a member of the tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). 1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol is considered to be a practically insoluble (in water) and a very weak acidic compound. 1-[2-methyl-3-(methylthio) allyl]cyclohex-2-enol can be found in feces.

   

N-methyl-L-normetanephrinium

N-methyl-L-normetanephrinium

C10H16NO3+ (198.113)


   

2-(Oct-3-enoylamino)acetic acid

2-(Oct-3-enoylamino)acetic acid

C10H16NO3+ (198.113)


   

Ecgononium methyl ester(1+)

Ecgononium methyl ester(1+)

C10H16NO3+ (198.113)


An organic cation that is the conjugate acid of ecgonone methyl ester arising from protonation of the tertiary amino group; major species at pH 7.3.

   

4,5,6,7-Tetrahydro-2-phenylbenzofuran

4,5,6,7-Tetrahydro-2-phenylbenzofuran

C14H14O (198.1045)


   

Para-(alpha-methylbenzyl(5D))phenol

Para-(alpha-methylbenzyl(5D))phenol

C14H14O (198.1045)


   

Dibenzyl ether

Dibenzyl ether

C14H14O (198.1045)


A benzyl ether in which the oxygen atom is connected to two benzyl groups.

   

1-[2-Methyl-3-(methylthio)allyl]cyclohex-2-enol

1-[2-Methyl-3-(methylthio)allyl]cyclohex-2-enol

C11H18OS (198.1078)


   

Cyclo(Thr-Pro)

Cyclo(Thr-Pro)

C9H14N2O3 (198.1004)


   

tetradec-6-en-8,10,12-triyn-3-one

tetradec-6-en-8,10,12-triyn-3-one

C14H14O (198.1045)


   

(4e,6e)-tetradeca-4,6-dien-8,10,12-triyn-1-ol

(4e,6e)-tetradeca-4,6-dien-8,10,12-triyn-1-ol

C14H14O (198.1045)


   

5-hydroxy-6-(1-methoxyethyl)-1-methyl-3-methylidene-6h-pyrazin-2-one

5-hydroxy-6-(1-methoxyethyl)-1-methyl-3-methylidene-6h-pyrazin-2-one

C9H14N2O3 (198.1004)


   

2-methyl-3-(2',3',4'-trihydroxy-butyl)pyrazine

2-methyl-3-(2',3',4'-trihydroxybutyl)pyrazine

C9H14N2O3 (198.1004)


{"Ingredient_id": "HBIN005961","Ingredient_name": "2-methyl-3-(2',3',4'-trihydroxy-butyl)pyrazine","Alias": "2-methyl-3-(2',3',4'-trihydroxybutyl)pyrazine","Ingredient_formula": "C9H14N2O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31690;14772","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4,5-epoxy-6-tetradecene-8,10,12-triyn-1-ol

NA

C14H14O (198.1045)


{"Ingredient_id": "HBIN010040","Ingredient_name": "4,5-epoxy-6-tetradecene-8,10,12-triyn-1-ol","Alias": "NA","Ingredient_formula": "C14H14O","Ingredient_Smile": "NA","Ingredient_weight": "198.26","OB_score": "NA","CAS_id": "17098-67-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7912","PubChem_id": "NA","DrugBank_id": "NA"}

   

4,6-tetradecadiene-8,10,12-triyn-1-ol

NA

C14H14O (198.1045)


{"Ingredient_id": "HBIN010086","Ingredient_name": "4,6-tetradecadiene-8,10,12-triyn-1-ol","Alias": "NA","Ingredient_formula": "C14H14O","Ingredient_Smile": "CC#CC#CC#CC=CC=CCCCO","Ingredient_weight": "198.26 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7899","PubChem_id": "71353587","DrugBank_id": "NA"}

   

6-tetradecene-8,10,12-triyn-3-one

NA

C14H14O (198.1045)


{"Ingredient_id": "HBIN012826","Ingredient_name": "6-tetradecene-8,10,12-triyn-3-one","Alias": "NA","Ingredient_formula": "C14H14O","Ingredient_Smile": "CCC(=O)CCC=CC#CC#CC#CC","Ingredient_weight": "198.26","OB_score": "NA","CAS_id": "37064-08-7","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7519","PubChem_id": "5321840","DrugBank_id": "NA"}

   

1-(3,8-dimethylazulen-5-yl)ethanone

1-(3,8-dimethylazulen-5-yl)ethanone

C14H14O (198.1045)


   

5-hydroxy-6-[(1r)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

5-hydroxy-6-[(1r)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

C9H14N2O3 (198.1004)


   

(6s)-5-hydroxy-6-[(1s)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

(6s)-5-hydroxy-6-[(1s)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

C9H14N2O3 (198.1004)


   

(7e)-9-[(2-methylbut-3-en-2-yl)oxy]non-7-en-1,3,5-triyne

(7e)-9-[(2-methylbut-3-en-2-yl)oxy]non-7-en-1,3,5-triyne

C14H14O (198.1045)


   

(3s,8as)-1-hydroxy-3-[(1r)-1-hydroxyethyl]-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one

(3s,8as)-1-hydroxy-3-[(1r)-1-hydroxyethyl]-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one

C9H14N2O3 (198.1004)


   

(6e)-tetradec-6-en-8,10,12-triyn-3-one

(6e)-tetradec-6-en-8,10,12-triyn-3-one

C14H14O (198.1045)


   

tetradeca-4,6-dien-8,10,12-triyn-1-ol

tetradeca-4,6-dien-8,10,12-triyn-1-ol

C14H14O (198.1045)


   

(3-methylphenyl)(phenyl)methanol

(3-methylphenyl)(phenyl)methanol

C14H14O (198.1045)


   

(6s)-5-hydroxy-6-[(1r)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

(6s)-5-hydroxy-6-[(1r)-1-methoxyethyl]-1-methyl-3-methylidene-6h-pyrazin-2-one

C9H14N2O3 (198.1004)


   

9-[(2-methylbut-3-en-2-yl)oxy]non-7-en-1,3,5-triyne

9-[(2-methylbut-3-en-2-yl)oxy]non-7-en-1,3,5-triyne

C14H14O (198.1045)