Exact Mass: 179.9857

Exact Mass Matches: 179.9857

Found 421 metabolites which its exact mass value is equals to given mass value 179.9857, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

2,5-dichloro-2,5-cyclohexadiene-1,4-diol

1,4-Dihydroxyl-2,5-dichloro-2,5-cyclohexadiene

C6H6Cl2O2 (179.9745)

A cyclohexadienediol that is cyclohexa-2,5-diene-1,4-diol in which positions 2 and 5 are substituted by chlorines.

1,4-dichlorobenzene dihydrodiol

3,6-Dichloro-cis-1,2-dihydroxycyclohexa-3,5-diene

C6H6Cl2O2 (179.9745)

1,4-dichlorobenzene dihydrodiol, also known as 3,6-dichloro-cis-1,2-dihydroxycyclohexa-3,5-diene, is a member of the class of compounds known as chlorohydrins. Chlorohydrins are alcohols substituted by a chlorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups. 1,4-dichlorobenzene dihydrodiol is soluble (in water) and a very weakly acidic compound (based on its pKa). 1,4-dichlorobenzene dihydrodiol can be found in a number of food items such as parsley, white lupine, radish, and mamey sapote, which makes 1,4-dichlorobenzene dihydrodiol a potential biomarker for the consumption of these food products.

2,4,6-Trimethyl-1,3,5-trithiane

(2alpha,4alpha,6alpha)-2,4,6-Trimethyl-1,3,5-trithiane

C6H12S3 (180.0101)

Modifier for blackcurrant flavou

1-(Methylthio)ethyl 2-propenyl disulfide

3-{[1-(methylsulphanyl)ethyl]disulphanyl}prop-1-ene

C6H12S3 (180.0101)

1-(Methylthio)ethyl 2-propenyl disulfide is found in onion-family vegetables. 1-(Methylthio)ethyl 2-propenyl disulfide is a constituent of the essential oil of Allium tuberosum (Chinese chives)

2,5-Dimethyl-1,4-dithiane-2,5-diol

2,5-Dimethyl-2, 5-dihydroxy-1,4-dithiane

C6H12O2S2 (180.0279)

2,5-Dimethyl-1,4-dithiane-2,5-diol is a flavouring ingredient. Flavouring ingredient

Ethyl 2-(methyldithio)propionate

Propanoic acid, 2-(methyldithio)-, ethyl ester

C6H12O2S2 (180.0279)

Ethyl 2-(methyldithio)propionate is a flavouring agent for baked goods and seasonings. Flavouring agent for baked goods and seasonings

(2S)-2-Amino-3-[(2-chloroacetyl)amino]propanoic acid

C5H9ClN2O3 (180.0302)

1-Methyl-1H-imidazole-2-sulfonyl chloride

1-Methyl-1H-imidazole-2-sulphonyl chloride

C4H5ClN2O2S (179.976)

4-Chlorobenzotrifluoride

4-chloro-alpha,alpha,alpha-Trifluorotoluene

C7H4ClF3 (179.9954)

5-Amino-1,3,4-thiadiazole-2-sulfonamide

5-imino-4,5-dihydro-1,3,4-thiadiazole-2-sulfonamide

C2H4N4O2S2 (179.9776)

Fluoromethyl 2,2-difluoro-1-(trifluoromethyl)vinyl ether

C4H2F6O (180.001)

D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics

2,4-Bis(methylthio)butyric acid

2,4-Bis(methylsulphanyl)butanoic acid

C6H12O2S2 (180.0279)

Propyl allyl trisulfide

1-(Prop-2-en-1-yl)-3-propyltrisulphane

C6H12S3 (180.0101)

Propyl allyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR (R,R=alkyl, aryl). Propyl allyl trisulfide can be found in soft-necked garlic, which makes propyl allyl trisulfide a potential biomarker for the consumption of this food product.

cis-3,5-Diethyl-1,2,4-trithiolane

(3R,5S)-3,5-diethyl-1,2,4-trithiolane

C6H12S3 (180.0101)

Cis-3,5-diethyl-1,2,4-trithiolane is a member of the class of compounds known as trithiolanes. Trithiolanes are organic compounds containing a six-member aliphatic saturated heterocycle made up of three sulfur atoms and two carbon atoms. Cis-3,5-diethyl-1,2,4-trithiolane can be found in garden onion, which makes cis-3,5-diethyl-1,2,4-trithiolane a potential biomarker for the consumption of this food product.

cis-Propenyl propyl trisulfide

1-[(1Z)-Prop-1-en-1-yl]-3-propyltrisulphane

C6H12S3 (180.0101)

Cis-propenyl propyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR (R,R=alkyl, aryl). Cis-propenyl propyl trisulfide can be found in garden onion, which makes cis-propenyl propyl trisulfide a potential biomarker for the consumption of this food product.

trans-Propenyl propyl trisulfide

1-[(1E)-Prop-1-en-1-yl]-3-propyltrisulphane

C6H12S3 (180.0101)

Trans-propenyl propyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR (R,R=alkyl, aryl). Trans-propenyl propyl trisulfide can be found in garden onion, which makes trans-propenyl propyl trisulfide a potential biomarker for the consumption of this food product.

trans-3,5-Diethyl-1,2,4,-trithiolane

(3R,5R)-3,5-diethyl-1,2,4-trithiolane

C6H12S3 (180.0101)

Trans-3,5-diethyl-1,2,4,-trithiolane can be found in garden onion, which makes trans-3,5-diethyl-1,2,4,-trithiolane a potential biomarker for the consumption of this food product.

(+/-)-cis- and trans-3,5-Diethyl-1,2,4-trithiolane

C6H12S3 (180.0101)

(+/-)-cis- and trans-3,5-diethyl-1,2,4-trithiolane is a member of the class of compounds known as trithiolanes. Trithiolanes are organic compounds containing a six-member aliphatic saturated heterocycle made up of three sulfur atoms and two carbon atoms (+/-)-cis- and trans-3,5-diethyl-1,2,4-trithiolane is a sulfurous tasting compound found in chives and soft-necked garlic, which makes (+/-)-cis- and trans-3,5-diethyl-1,2,4-trithiolane a potential biomarker for the consumption of these food products.

Potassium salts of fatty acids

tetrafluorocyclohexa-2,5-diene-1,4-dione

C6F4O2 (179.9834)

It is used as a food additive .

Sodium n-alkylbenzenesulfonate

Benzenesulfonic acid, magnesium salt

C6H5NaO3S (179.9857)

It is used as a food additive .

asparagusic acid anti-S-oxide methyl ester|asparagusic acid syn-S-oxide methyl ester|cis-1,2-dithiolane-4-carboxylic acid-1-oxide methyl ester|trans-1,2-dithiolane-4-carboxylic acid-1-oxide methyl ester

asparagusic acid anti-S-oxide methyl ester|asparagusic acid syn-S-oxide methyl ester|cis-1,2-dithiolane-4-carboxylic acid-1-oxide methyl ester|trans-1,2-dithiolane-4-carboxylic acid-1-oxide methyl ester

C5H8O3S2 (179.9915)

1-(3-hydroxy-5-prop-1-ynyl-thiophen-2-yl)-ethanone|2-Acetyl-3-hydroxy-5-(1-propynyl)thiophene|3-Hydroxy-5-propin-(1)-yl-2-acetyl-thiophen

C9H8O2S (180.0245)

Pyrrolomycin A

C4H2Cl2N2O2 (179.9493)

A member of the class of pyrroles that is 1H-pyrrole which is substituted by chloro groups at positions 2 and 3 and by a nitro group position 4. It is the simplest member of the pyrrolomycins, a family of natural products found in several species of the Streptomyces genus. The compound is active against Gram-positive and Gram-negative bacteria and some genera of fungi.