Exact Mass: 190.126553

Exact Mass Matches: 190.126553

Found 106 metabolites which its exact mass value is equals to given mass value 190.126553, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

beta-Damascenone

1-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-buten-1-one; 1-(2,6,6-Trimethyl-1,3-cyclohexadienyl)-2-buten-1-one; 1-Crotonoyl-2,6,6-trimethyl-1,3-cyclohexadiene; 2,6,6-Trimethyl-1-(2-butenoyl)-1,3-cyclohexadiene

C13H18O (190.1357578)


Beta-damascenone is a cyclic monoterpene ketone that is 2,6,6-trimethylcyclohexa-1,3-diene substituted at position 1 by a crotonoyl group. It has a role as a fragrance, a volatile oil component and a plant metabolite. It is an enone, an apo carotenoid monoterpenoid and a cyclic monoterpene ketone. Damascenone is a natural product found in Vitis rotundifolia, Vitis labrusca, and other organisms with data available. 1-[2,6,6-Trimethyl-1,3-cyclohexadien-1-yl]-2-buten-1-one is a metabolite found in or produced by Saccharomyces cerevisiae. trans-beta-damascenone is a metabolite found in or produced by Saccharomyces cerevisiae. Damascenones are a series of closely related chemical compounds that are components of a variety of essential oils. The damascenones belong to a family of chemicals known as rose ketones, which also includes damascones and ionones. beta-Damascenone is a major contributor to the aroma of roses, despite its very low concentration, and is an important fragrance chemical used in perfumery. [Wikipedia] From Rosa damascena and many other sources. 3,5,8-Megastigmatrien-7-one is found in many foods, some of which are herbs and spices, tea, common grape, and green vegetables. A cyclic monoterpene ketone that is 2,6,6-trimethylcyclohexa-1,3-diene substituted at position 1 by a crotonoyl group. Damascenone ((E/Z)-Damascenone) is an active compound of?Epipremnum pinnatum with anti-inflammatory activity[1]. Damascenone is a mixture complex of?E-isomer-Damascenone and Z-isomer Damascenone. Damascenone ((E/Z)-Damascenone) is an active compound of?Epipremnum pinnatum with anti-inflammatory activity[1]. Damascenone is a mixture complex of?E-isomer-Damascenone and Z-isomer Damascenone.

   

2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one

1,4,5,7a-tetrahydro-1,4,4,7a-Tetramethyl-2H-inden-2-one, 9ci

C13H18O (190.1357578)


2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one is found in fruits. 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one is from quince (Cydonia oblonga). From quince (Cydonia oblonga). 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one is found in quince and fruits.

   

Megastigmatrienone

4-[(1E)-buta-1,3-dien-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one

C13H18O (190.1357578)


Megastigmatrienone belongs to the family of Ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be H).

   

xi-3-(4-Isopropylphenyl)-2-methylpropanal

2-methyl-3-[4-(propan-2-yl)phenyl]propanal

C13H18O (190.1357578)


3-(4-Isopropylphenyl)-2-methylpropanal is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]").

   

dehydro-beta-Ionone

(3E)-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-3-en-2-one

C13H18O (190.1357578)


dehydro-beta-Ionone belongs to the family of Enones. These are compounds containing the enone functional group, with the structure RC(=O)CR

   

2-(3-Phenylpropyl)tetrahydrofuran

tetrahydro-2-(3-Phenylpropyl)furan, 9ci

C13H18O (190.1357578)


2-(3-Phenylpropyl)tetrahydrofuran is a flavouring ingredien Flavouring ingredient

   

Heptanophenone

1-Phenyl-1-heptanone

C13H18O (190.1357578)


   

methyl 5,7-dihydroxyoctanoate

methyl 5,7-dihydroxyoctanoate

C9H18O4 (190.1205028)


   

Ethyl 3,3-diethoxypropionate

Ethyl 3,3-diethoxypropionate

C9H18O4 (190.1205028)


   

Ethyl 2,2-diethoxypropionate

Ethyl 2,2-diethoxypropionate

C9H18O4 (190.1205028)


   

bisabolene-1-one

bisabolene-1-one

C13H18O (190.1357578)


   

3-buta-1,3-dienyl-2,4,4-trimethylcyclohex-2-en-1-one

3-buta-1,3-dienyl-2,4,4-trimethylcyclohex-2-en-1-one

C13H18O (190.1357578)


   
   

(2,4-diethoxytetrahydrofuran-3-yl)methanol|brachystemol A

(2,4-diethoxytetrahydrofuran-3-yl)methanol|brachystemol A

C9H18O4 (190.1205028)


   

(4,5-diethoxytetrahydrofuran-3-yl)methanol|brachystemol B

(4,5-diethoxytetrahydrofuran-3-yl)methanol|brachystemol B

C9H18O4 (190.1205028)


   

SCHEMBL10282538

SCHEMBL10282538

C9H18O4 (190.1205028)


   
   

(5-Isopropyl-2-methyl-phenyl)-aceton|(5-isopropyl-2-methyl-phenyl)-acetone|Methyl-2-methyl-5-isopropylbenzylketon

(5-Isopropyl-2-methyl-phenyl)-aceton|(5-isopropyl-2-methyl-phenyl)-acetone|Methyl-2-methyl-5-isopropylbenzylketon

C13H18O (190.1357578)


   

Megastigmatrienone

Megastigmatrienone

C13H18O (190.1357578)


   

4-(2,6,6-Trimethylcyclohexa-1,3-dienyl)but-3-en-2-one

4-(2,6,6-Trimethylcyclohexa-1,3-dienyl)but-3-en-2-one

C13H18O (190.1357578)


   

Damascenone

2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2E)-

C13H18O (190.1357578)


Damascenone ((E/Z)-Damascenone) is an active compound of?Epipremnum pinnatum with anti-inflammatory activity[1]. Damascenone is a mixture complex of?E-isomer-Damascenone and Z-isomer Damascenone. Damascenone ((E/Z)-Damascenone) is an active compound of?Epipremnum pinnatum with anti-inflammatory activity[1]. Damascenone is a mixture complex of?E-isomer-Damascenone and Z-isomer Damascenone.

   

FEMA 2898

tetrahydro-2-(3-Phenylpropyl)furan, 9ci

C13H18O (190.1357578)


   

2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien

1,4,5,7a-tetrahydro-1,4,4,7a-Tetramethyl-2H-inden-2-one, 9ci

C13H18O (190.1357578)


   

xi-3-(4-Isopropylphenyl)-2-methylpropanal

2-methyl-3-[4-(propan-2-yl)phenyl]propanal

C13H18O (190.1357578)


   

Dicyclopentadiene, allyl alcohol polymer

Dicyclopentadiene, allyl alcohol polymer

C13H18O (190.1357578)


   

Cyclamen aldehyde

3-(4-Isopropylphenyl)-2-methylpropanal

C13H18O (190.1357578)


It is used as a food additive. Cyclamen aldehyde. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=103-95-7 (retrieved 2024-07-09) (CAS RN: 103-95-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Benzene,1-cyclohexyl-4-methoxy-

Benzene,1-cyclohexyl-4-methoxy-

C13H18O (190.1357578)


   

1,5-DI-TERT-BUTYL-1,4-PENTADIYN-3-ONE

1,5-DI-TERT-BUTYL-1,4-PENTADIYN-3-ONE

C13H18O (190.1357578)


   

2-Pentanone,4-methyl-4-(4-methylphenyl)-

2-Pentanone,4-methyl-4-(4-methylphenyl)-

C13H18O (190.1357578)


   

N-BUTYL-N-(2,4-DIHYDROXYBUTYL)NITROSAMINE

N-BUTYL-N-(2,4-DIHYDROXYBUTYL)NITROSAMINE

C8H18N2O3 (190.1317358)


   

1-(4-butan-2-ylphenyl)propan-1-one

1-(4-butan-2-ylphenyl)propan-1-one

C13H18O (190.1357578)


   

1-Propanone,1-[4-(1,1-dimethylethyl)phenyl]-

1-Propanone,1-[4-(1,1-dimethylethyl)phenyl]-

C13H18O (190.1357578)


   

2-(4-ISOBUTYRYLPHENYL)PROPANE

2-(4-ISOBUTYRYLPHENYL)PROPANE

C13H18O (190.1357578)


   

3-(4-Isopropyl-2-methylphenyl)propanal

3-(4-Isopropyl-2-methylphenyl)propanal

C13H18O (190.1357578)


   

3-[3-(2-Methyl-2-propanyl)phenyl]propanal

3-[3-(2-Methyl-2-propanyl)phenyl]propanal

C13H18O (190.1357578)


   

Bourgeonal

3-(4-Tert-butylphenyl)propanal

C13H18O (190.1357578)


   

Dipropyleneglycol methyl ether acetate

Dipropyleneglycol methyl ether acetate

C9H18O4 (190.1205028)


   

3-(4-Ethylphenyl)-2,2-dimethylpropanal

3-(4-Ethylphenyl)-2,2-dimethylpropanal

C13H18O (190.1357578)


   

1-N-Boc-1-(2-methoxyethyl)hydrazine

1-N-Boc-1-(2-methoxyethyl)hydrazine

C8H18N2O3 (190.1317358)


   

1-(4-tert-butylphenyl)propan-2-one

1-(4-tert-butylphenyl)propan-2-one

C13H18O (190.1357578)


   

2-Cyclohexyl-5-methylphenol

2-Cyclohexyl-5-methylphenol

C13H18O (190.1357578)


   

N-BOC-1,3-DIAMINO-2-PROPANOL

N-BOC-1,3-DIAMINO-2-PROPANOL

C8H18N2O3 (190.1317358)


   

(4-ethenylphenyl)methyl-trimethylsilane

(4-ethenylphenyl)methyl-trimethylsilane

C12H18Si (190.11777080000002)


   

N-(2,2-Diethoxyethyl)-N-methyl-urea

N-(2,2-Diethoxyethyl)-N-methyl-urea

C8H18N2O3 (190.1317358)


   
   

2,2,4,6,7-Pentamethyldihydrobenzofuran

2,2,4,6,7-Pentamethyldihydrobenzofuran

C13H18O (190.1357578)


   

2-[1,3-bis(dimethylamino)-2-propenylidene]malononitrile

2-[1,3-bis(dimethylamino)-2-propenylidene]malononitrile

C10H14N4 (190.1218404)


   

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

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

C13H18O (190.1357578)


   

4-(4-ISOPROPYLPHENYL)BUTAN-2-ONE

4-(4-ISOPROPYLPHENYL)BUTAN-2-ONE

C13H18O (190.1357578)


   

l-lysine-3,3,4,4,5,5,6,6-d8 hcl

l-lysine-3,3,4,4,5,5,6,6-d8 hcl

C6H7ClD8N2O2 (190.132417424)


   

triisopropylsilanethiol

triisopropylsilanethiol

C9H22SSi (190.1211412)


   

2,2-Bi-1H-imidazole,4,4,5,5-tetramethyl-

2,2-Bi-1H-imidazole,4,4,5,5-tetramethyl-

C10H14N4 (190.1218404)


   

4-(3,3-Difluoropyrrolidin-1-yl)piperidine

4-(3,3-Difluoropyrrolidin-1-yl)piperidine

C9H16F2N2 (190.128148)


   

(S)-1-[4-(2-Methylbutyl)phenyl]ethanone

(S)-1-[4-(2-Methylbutyl)phenyl]ethanone

C13H18O (190.1357578)


   

Phenol,2-cyclohexyl-4-methyl-

Phenol,2-cyclohexyl-4-methyl-

C13H18O (190.1357578)


   

6-[(2-Amino-2-methylpropyl)amino]nicotinonitrile

6-[(2-Amino-2-methylpropyl)amino]nicotinonitrile

C10H14N4 (190.1218404)


   

2-(4-isobutylphenyl)propionaldehyde

2-(4-isobutylphenyl)propionaldehyde

C13H18O (190.1357578)


   

4-METHYL-1-PHENYL-HEX-5-EN-3-OL

4-METHYL-1-PHENYL-HEX-5-EN-3-OL

C13H18O (190.1357578)


   

2,3,4,5,6-pentamethylacetophenone

2,3,4,5,6-pentamethylacetophenone

C13H18O (190.1357578)


   

Benzene,1-cyclohexyl-2-methoxy-

Benzene,1-cyclohexyl-2-methoxy-

C13H18O (190.1357578)


   

Cyclohexanol,1-(phenylmethyl)-

Cyclohexanol,1-(phenylmethyl)-

C13H18O (190.1357578)


   

cyclohexyl(phenyl)methanol

cyclohexyl(phenyl)methanol

C13H18O (190.1357578)


   

(R)-(+)-1-BENZYLOXY-BUTANE-2-OL

(R)-(+)-1-BENZYLOXY-BUTANE-2-OL

C13H18O (190.1357578)


   

2-(4-CARBAMIMIDOYLMETHYL-PHENYL)-ACETAMIDINE

2-(4-CARBAMIMIDOYLMETHYL-PHENYL)-ACETAMIDINE

C10H14N4 (190.1218404)


   

4-N-HEXYLBENZALDEHYDE

4-N-HEXYLBENZALDEHYDE

C13H18O (190.1357578)


   

4-Pentylacetophenone

4-Pentylacetophenone

C13H18O (190.1357578)


   

Cyclopropyl-Methyl-(S)-piperidin-3-yl-aMine hydrochloride

Cyclopropyl-Methyl-(S)-piperidin-3-yl-aMine hydrochloride

C9H19ClN2 (190.12366839999999)


   

tert-Butyl (S)-[1-(aminooxy)propan-2-yl]carbamate

tert-Butyl (S)-[1-(aminooxy)propan-2-yl]carbamate

C8H18N2O3 (190.1317358)


   

5-Amino-3-cyclopentyl-1-methyl-1H-pyrazole-4-carbonitrile

5-Amino-3-cyclopentyl-1-methyl-1H-pyrazole-4-carbonitrile

C10H14N4 (190.1218404)


   

1,3-Diethyl-1,1,3,3-Tetramethyl Disiloxane

1,3-Diethyl-1,1,3,3-Tetramethyl Disiloxane

C8H22OSi2 (190.1209122)


   

1-Phenyl-2-heptanone

1-Phenyl-2-heptanone

C13H18O (190.1357578)


   
   

(4-Phenylcyclohexyl)methanol

(4-Phenylcyclohexyl)methanol

C13H18O (190.1357578)


   

3-[4-(2-methylpropyl)phenyl]propanal

3-[4-(2-methylpropyl)phenyl]propanal

C13H18O (190.1357578)


   

Butyrylthiocholine

Butyrylthiocholine

C9H20NOS+ (190.126553)


   

2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2Z)-

2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2Z)-

C13H18O (190.1357578)


   

Tert-butyl 3-aminopropoxycarbamate

Tert-butyl 3-aminopropoxycarbamate

C8H18N2O3 (190.1317358)


   

5-Methyl-5-phenylhexan-3-one

5-Methyl-5-phenylhexan-3-one

C13H18O (190.1357578)


   

2,3-Dihydroxypropyl hexanoate

2,3-Dihydroxypropyl hexanoate

C9H18O4 (190.1205028)


   

Trimethyl-(4-prop-1-en-2-ylphenyl)silane

Trimethyl-(4-prop-1-en-2-ylphenyl)silane

C12H18Si (190.11777080000002)


   

2-(4-tert-Butylphenyl)propanal

2-(4-tert-Butylphenyl)propanal

C13H18O (190.1357578)


   
   

(3R)-3,9-dihydroxynonanoic acid

(3R)-3,9-dihydroxynonanoic acid

C9H18O4 (190.1205028)


A dihydroxy monocarboxylic acid that is 9-hydroxynonanoic acid in which the pro-R hydrogen beta to the carboxy group is replaced by a hydroxy group.

   

(3R,8R)-3,8-dihydroxynonanoic acid

(3R,8R)-3,8-dihydroxynonanoic acid

C9H18O4 (190.1205028)


An (omega-1)-hydroxy fatty acid that is (8R)-8-hydroxynonanoic acid in which the 3-pro-R hydrogen is replaced by a hydroxy group.

   

alpha-[(Z)-2-Hexenyl]benzenemethanol

alpha-[(Z)-2-Hexenyl]benzenemethanol

C13H18O (190.1357578)


   

10-Isopropenyl-3,7-cyclodecadien-1-one

10-Isopropenyl-3,7-cyclodecadien-1-one

C13H18O (190.1357578)


   

1-Phenyl-2-trimethylsilylcyclopropane

1-Phenyl-2-trimethylsilylcyclopropane

C12H18Si (190.11777080000002)


   

(4S,5S)-4,5-Bis(methoxymethyl)-2,2-dimethyl-1,3-dioxolane

(4S,5S)-4,5-Bis(methoxymethyl)-2,2-dimethyl-1,3-dioxolane

C9H18O4 (190.1205028)


   

Propyl (3S)-3-hydroxy-5-methoxypentanoate

Propyl (3S)-3-hydroxy-5-methoxypentanoate

C9H18O4 (190.1205028)


   

2-Hydroxymethyl-2-methylpropane-1,3diol dimethyl ether monoacetate

2-Hydroxymethyl-2-methylpropane-1,3diol dimethyl ether monoacetate

C9H18O4 (190.1205028)


   

2-phenyl propyl tetrahydrofuran

2-(3-Phenylpropyl)tetrahydrofuran

C13H18O (190.1357578)


   

2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one

2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-one

C13H18O (190.1357578)


   

(5s)-5-hydroxyhexyl (2s)-2-hydroxypropanoate

(5s)-5-hydroxyhexyl (2s)-2-hydroxypropanoate

C9H18O4 (190.1205028)


   

β-damascenone

NA

C13H18O (190.1357578)


{"Ingredient_id": "HBIN018046","Ingredient_name": "\u03b2-damascenone","Alias": "NA","Ingredient_formula": "C13H18O","Ingredient_Smile": "CC=CC(=O)C1=C(C=CCC1(C)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37226","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

Bicyclo[6.3.0]undeca-1,7-dien-3-one, 5,5-dimethyl-

(3aZ,9Z)-7,7-dimethyl-2,3,6,8-tetrahydro-1H-cyclopenta[8]annulen-5-one

C13H18O (190.1357578)


{"Ingredient_id": "HBIN018462","Ingredient_name": "Bicyclo[6.3.0]undeca-1,7-dien-3-one, 5,5-dimethyl-","Alias": "(3aZ,9Z)-7,7-dimethyl-2,3,6,8-tetrahydro-1H-cyclopenta[8]annulen-5-one","Ingredient_formula": "C13H18O","Ingredient_Smile": "CC1(CC=C2CCCC2=CC(=O)C1)C","Ingredient_weight": "190.28 g/mol","OB_score": "46.50396681","CAS_id": "NA","SymMap_id": "SMIT13928","TCMID_id": "NA","TCMSP_id": "MOL013249","TCM_ID_id": "NA","PubChem_id": "5372011","DrugBank_id": "NA"}

   

1-ethyl-4-[(3-methylbut-2-en-1-yl)oxy]benzene

1-ethyl-4-[(3-methylbut-2-en-1-yl)oxy]benzene

C13H18O (190.1357578)


   

[(3s,4r,5r)-4,5-diethoxyoxolan-3-yl]methanol

[(3s,4r,5r)-4,5-diethoxyoxolan-3-yl]methanol

C9H18O4 (190.1205028)


   

7-phenylheptan-3-one

7-phenylheptan-3-one

C13H18O (190.1357578)


   

[(2r,3s,4s)-2,4-diethoxyoxolan-3-yl]methanol

[(2r,3s,4s)-2,4-diethoxyoxolan-3-yl]methanol

C9H18O4 (190.1205028)


   

(1s,7as)-1,4,4,7a-tetramethyl-1,5-dihydroinden-2-one

(1s,7as)-1,4,4,7a-tetramethyl-1,5-dihydroinden-2-one

C13H18O (190.1357578)


   

(1s,2s,8r)-2-methyl-7-methylidenetricyclo[6.2.1.0¹,⁵]undecan-6-one

(1s,2s,8r)-2-methyl-7-methylidenetricyclo[6.2.1.0¹,⁵]undecan-6-one

C13H18O (190.1357578)


   

4-(2-hydroxyethyl)-5-(hydroxymethyl)-1-methylcyclopentane-1,3-diol

4-(2-hydroxyethyl)-5-(hydroxymethyl)-1-methylcyclopentane-1,3-diol

C9H18O4 (190.1205028)


   

megastigmatrienone a

megastigmatrienone a

C13H18O (190.1357578)


   

methyl (5s,7s)-5,7-dihydroxyoctanoate

methyl (5s,7s)-5,7-dihydroxyoctanoate

C9H18O4 (190.1205028)


   

(1s,3r,4r,5r)-4-(2-hydroxyethyl)-5-(hydroxymethyl)-1-methylcyclopentane-1,3-diol

(1s,3r,4r,5r)-4-(2-hydroxyethyl)-5-(hydroxymethyl)-1-methylcyclopentane-1,3-diol

C9H18O4 (190.1205028)