Exact Mass: 107.99780600000001

Exact Mass Matches: 107.99780600000001

Found 132 metabolites which its exact mass value is equals to given mass value 107.99780600000001, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Quinone

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

C6H4O2 (108.0211284)


Quinone is also called 1,4-benzoquinone or cyclohexadienedione. Quinones are oxidized derivatives of aromatic compounds and are often readily made from reactive aromatic compounds with electron-donating substituents such as phenols and catechols, which increase the nucleophilicity of the ring and contributes to the large redox potential needed to break aromaticity. Derivatives of quinones are common constituents of biologically relevant molecules. Some serve as electron acceptors in electron transport chains such as those in photosynthesis (plastoquinone, phylloquinone), and aerobic respiration (ubiquinone). Quinone is a common constituent of biologically relevant molecules (e.g. Vitamin K1 is phylloquinone). A natural example of quinones as oxidizing agents is the spray of bombardier beetles. Hydroquinone is reacted with hydrogen peroxide to produce a fiery blast of steam, a strong deterent in the animal world. 1,4-Benzoquinone, commonly known as para-quinone or quinone, is a chemical compound with the formula C6H4O2. 1,4-Benzoquinone is found in barley, olive, and anise. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

1,2-Benzoquinone

3,5-Cyclohexadiene-1,2-dione (9ci)

C6H4O2 (108.0211284)


1,2-Benzoquinone is a reactive electrophile that is an intermediate in benzene metabolism. It is substrate for the enzyme Catechol oxidase (EC 1.10.3.1) and can be generated from the oxidation of catechol. 1,2-Benzoquinone is capable of reacting with blood proteins to produce adducts. 1,2-Benzoquinone, also called ortho-benzoquinone or cyclohexa-3,5-diene-1,2-dione, is a ketone, with formula C6H4O2. It is one of the two isomers of quinone, the other being 1,4-benzoquinone. O-Quinone is found in tea.

   

Bromoethane

Ethyl bromide

C2H5Br (107.957459)


   

2-Chloropropanoic acid

R(+)-2-CHLOROPROPIONIC ACID

C3H5ClO2 (107.99780600000001)


   

Bis(methylthio)methane

Thioformaldehyde dimethylthioacetal

C3H8S2 (108.0067408)


Bis(methylthio)methane is found in animal foods. Bis(methylthio)methane is a odorous constituent of white truffle (Tuber magnatum); volatile component of some cheeses and boiled beef aroma. Also found in milk, fish oils, shitake mushroom, truffles, prawns and lobster. Bis(methylthio)methane is an important off-flavour component of foods. Bis(methylthio)methane is used in seasonings. It is used as a primary aromatic ingredient in truffle oil when combined in an olive oil base Odorous constituent of white truffle (Tuber magnatum); volatile component of some cheeses and boiled beef aromaand is also found in milk, fish oils, shitake mushroom, truffles, prawns and lobster. Important off-flavour component of foods. It is used in seasonings

   

1,2-Propanedithiol

1,2-Propanedithiol-propylene dimercaptan

C3H8S2 (108.0067408)


1,2-Propanedithiol, sometimes called 1,2-dimercaptopropane, is a thiol with the formula HSCH2CH(SH)CH3. This colorless, intensely odorous liquid is the simplest chiral dithiol. Related dithiols include 1,2-ethanedithiol, 2,3-dimercapto-1-propanesulfonic acid, and 1,3-propanedithiol. It is generated by the addition of H2S to the related episulfide, CH3CHCH2S. (±)-1,2-Propanedithiol is a flavouring ingredien

   

1,3-Propanedithiol

Dithiotrimethyleneglycol

C3H8S2 (108.0067408)


1,3-Propanedithiol is a flavouring ingredient.1,3-Propanedithiol is the chemical compound with the formula HSCH2CH2CH2SH. This dithiol is a useful reagent in organic synthesis. This liquid, which is readily available commercially, has an intense stench Flavouring ingredient

   

Ethyl methyl disulfide

Ethanesulfenothioic acid, methyl ester

C3H8S2 (108.0067408)


Constituent of Allium subspecies and Durio zibethinus (durian). Ethyl methyl disulfide is found in kohlrabi, onion-family vegetables, and fruits. Ethyl methyl disulfide is found in fruits. Ethyl methyl disulfide is a constituent of Allium species and Durio zibethinus (durian).

   

2,2-Dihydroperoxypropane

(1-Methylethylidene)bis[hydroperoxide], 9ci

C3H8O4 (108.0422568)


2,2-Dihydroperoxypropane is a mixture of acetone peroxides (usually supplied adsorbed onto an inert carrier such as cornstarch) is added to foods as a beleaching agent and dough conditone A mixture of acetone peroxides (usually supplied adsorbed onto an inert carrier such as cornstarch) is added to foods as a beleaching agent and dough conditoner

   

(2R)-3-Sulfanylpropane-1,2-diol

(2R)-3-Sulphanylpropane-1,2-diol

C3H8O2S (108.0244988)


   

2-Chloropropionic acid

2-Chloropropionic acid, sodium salt

C3H5ClO2 (107.99780600000001)


   

4-Chloro-1-butanol

Hydroxypropyl methyl chloride

C4H9ClO (108.03418940000002)


   

Ethyl chloroformate

Ethyl chloroformate, 14C-labeled

C3H5ClO2 (107.99780600000001)


   

Furofuran

furo[3,2-b]furan

C6H4O2 (108.0211284)


   

Glycerol oxide

Glycerol oxide

C3H8O4 (108.0422568)


   
   

VINYLSULFONIC ACID

Ethylenesulfonic acid, sodium salt

C2H4O3S (107.9881154)


   

1-(methylthio)ethanethiol

1-(Methylsulphanyl)ethane-1-thiol

C3H8S2 (108.0067408)


Flavouring compound [Flavornet]

   
   

SCHEMBL8515219

SCHEMBL8515219

C3H8O4 (108.0422568)


   

Chlorotrimethylsilane

Chlorotrimethylsilane

C3H9ClSi (108.01620240000001)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

Nitrile-5-Methyl-3-isoxazolecarboxylic acid,9CI

Nitrile-5-Methyl-3-isoxazolecarboxylic acid,9CI

C5H4N2O (108.0323614)


   

Quinone

1,4-Benzoquinone

C6H4O2 (108.0211284)


   
   
   
   
   

2-chloro-N-nitroso-Ethanamine (Carmustine Metabolite)

2-chloro-N-nitroso-Ethanamine (Carmustine Metabolite)

C2H5ClN2O (108.009039)


   

CH3Sch2Sch3

Thioformaldehyde dimethylthioacetal

C3H8S2 (108.0067408)


   

FEMA 3520

1,2-Propanedithiol-propylene dimercaptan

C3H8S2 (108.0067408)


   

Trimethylenedithiol

Dithiotrimethyleneglycol

C3H8S2 (108.0067408)


   

Butyl diselenide

Ethanesulfenothioic acid, methyl ester

C3H8S2 (108.0067408)


   

Peroxyacetone

(1-Methylethylidene)bis[hydroperoxide], 9ci

C3H8O4 (108.0422568)


   

5-Pyrimidinecarbaldehyde

5-Pyrimidinecarbaldehyde

C5H4N2O (108.0323614)


   

2-chloro-acetamide oxime

2-chloro-acetamide oxime

C2H5ClN2O (108.009039)


   
   

1,3-Oxazol-2-ylacetonitrile

1,3-Oxazol-2-ylacetonitrile

C5H4N2O (108.0323614)


   
   
   

4,4,4-trifluorobuta-1,2-diene

4,4,4-trifluorobuta-1,2-diene

C4H3F3 (108.01868339999999)


   

Poly(thio-1,4-phenylene)

Poly(thio-1,4-phenylene)

C6H4S (108.0033704)


   
   

butylene chlorohydrin

butylene chlorohydrin

C4H9ClO (108.03418940000002)


A secondary alcohol that is butan-2-ol in which one of the methyl hydrogen atoms is substituted by chlorine.

   

4-Amino-1H-pyrazole-3-carbonitrile

4-Amino-1H-pyrazole-3-carbonitrile

C4H4N4 (108.04359439999999)


   
   
   

2-chloroacetohydrazide

2-chloroacetohydrazide

C2H5ClN2O (108.009039)


   

Pyrimidine-4-carbaldehyde

Pyrimidine-4-carbaldehyde

C5H4N2O (108.0323614)


   

5-Methylisoxazole-3-carbonitrile

5-Methyl-1,2-oxazole-3-carbonitrile

C5H4N2O (108.0323614)


   

Cyclopropylhydrazine hydrochloride (1:1)

Cyclopropylhydrazine hydrochloride (1:1)

C3H9ClN2 (108.0454224)


   

1-allylhydrazine hydrochloride

1-allylhydrazine hydrochloride

C3H9ClN2 (108.0454224)


   

ETHYL METHYLPHOSPHINATE

ETHYL METHYLPHOSPHINATE

C3H9O2P (108.0340144)


   

(Chloromethyl)thiirane

(Chloromethyl)thiirane

C3H5ClS (107.98004800000001)


(Chloromethyl)thiirane. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=3221-15-6 (retrieved 2024-06-26) (CAS RN: 3221-15-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   
   

Sodium polymethacrylate

Sodium polymethacrylate

C4H5NaO2 (108.01872300000001)


It is used as a food additive .

   
   

4-methyloxazole-5-carbonitrile

4-methyloxazole-5-carbonitrile

C5H4N2O (108.0323614)


   

3-Ethynylthiophene

3-Ethynylthiophene

C6H4S (108.0033704)


   
   
   
   

(2,2-Difluorocyclopropyl)methanol

(2,2-Difluorocyclopropyl)methanol

C4H6F2O (108.038669)


   

2-methyl-1,3-oxazole-4-carbonitrile

2-methyl-1,3-oxazole-4-carbonitrile

C5H4N2O (108.0323614)


   
   

1-sulfanylpropane-1,1-diol

1-sulfanylpropane-1,1-diol

C3H8O2S (108.0244988)


   
   

1H-1,2,4-Triazol-1-ylacetonitrile

1H-1,2,4-Triazol-1-ylacetonitrile

C4H4N4 (108.04359439999999)


   
   

Lithium 3-oxobutanoate

Lithium 3-oxobutanoate

C4H5LiO3 (108.039873)


Acetoacetic acid lithium is an endogenous metabolite.

   

1-NAPHTHALENEACETICACIDETHYLESTER

1-NAPHTHALENEACETICACIDETHYLESTER

C3H8O2S (108.0244988)


   

3-fluoro-D-(2-2H)alanine

3-fluoro-D-(2-2H)alanine

C3H5DFNO2 (108.044531978)


   

1-methylsiline

1-methylsiline

C6H8Si (108.0395248)


   

2-Pyrimidinecarbaldehyde

2-Pyrimidinecarbaldehyde

C5H4N2O (108.0323614)


   
   

2-Aminofuran-3-carbonitrile

2-Aminofuran-3-carbonitrile

C5H4N2O (108.0323614)


   

1,1,2-Trifluoro-1,3-butadiene

1,1,2-Trifluoro-1,3-butadiene

C4H3F3 (108.01868339999999)


   

Ethyl Methyl Sulfone

Ethyl Methyl Sulfone

C3H8O2S (108.0244988)


   

trimethylphosphine sulfide

trimethylphosphine sulfide

C3H9PS (108.0162564)


   
   

Magnesium azide

Magnesium azide

MgN6 (108.003494)


   

2-Pyrazinecarbaldehyde

2-Pyrazinecarbaldehyde

C5H4N2O (108.0323614)


   
   

dideuterio 2,2-dideuteriopropanedioate

dideuterio 2,2-dideuteriopropanedioate

C3D4O4 (108.03606711200001)


   
   
   

4-Pyridazinecarbaldehyde

4-Pyridazinecarbaldehyde

C5H4N2O (108.0323614)


   

5-Amino-1H-imidazol-4-carbonitrile

5-Amino-1H-imidazol-4-carbonitrile

C4H4N4 (108.04359439999999)


   

3-Pyridazinecarbaldehyde

3-Pyridazinecarbaldehyde

C5H4N2O (108.0323614)


   
   

Sulfur tetrafluoride

sulfur(+2) tetrahydride cation tetrafluoride

F4S (107.96568479999999)


D020011 - Protective Agents > D002327 - Cariostatic Agents > D005459 - Fluorides

   

1H-Pyrazole-3-carbonitrile,5-amino-(9CI)

1H-Pyrazole-3-carbonitrile,5-amino-(9CI)

C4H4N4 (108.04359439999999)


   

2,3-diaminobut-2-enedinitrile

2,3-diaminobut-2-enedinitrile

C4H4N4 (108.04359439999999)


   

Nitrogen pentoxide

dinitrogen pentaoxide

N2O5 (107.980723)


   

1,3-BIS(PHOSPHINO)PROPANE

1,3-BIS(PHOSPHINO)PROPANE

C3H10P2 (108.025772)


   

Propionimidamide hydrochloride

Propionimidamide hydrochloride

C3H9ClN2 (108.0454224)


   

R(+)-2-CHLOROPROPIONIC ACID

(R)-(+)-2-Chloropropionic acid

C3H5ClO2 (107.99780600000001)


   
   

2-Ethynylthiophene

2-Ethynylthiophene

C6H4S (108.0033704)


   
   

5-Amino-1H-pyrazole-4-carbonitrile

5-Amino-1H-pyrazole-4-carbonitrile

C4H4N4 (108.04359439999999)


   

2-acetylpropanedinitrile

2-acetylpropanedinitrile

C5H4N2O (108.0323614)


   
   

METHYLLITHIUM LITHIUM BROMIDE COMPLEX

METHYLLITHIUM LITHIUM BROMIDE COMPLEX

CH3BrLi2 (107.9738198)


   

3-methyl-5-isoxazolecarbonitrile(SALTDATA: FREE)

3-methyl-5-isoxazolecarbonitrile(SALTDATA: FREE)

C5H4N2O (108.0323614)


   

3,3-Difluorocyclobutanol

3,3-Difluorocyclobutanol

C4H6F2O (108.038669)


   
   

(2R)-3-Sulfanylpropane-1,2-diol

(2R)-3-Sulfanylpropane-1,2-diol

C3H8O2S (108.0244988)


   

Sulfinoacetaldehyde

Sulfinoacetaldehyde

C2H4O3S (107.9881154)


   

(2S)-3-fluoro-2-hydroxypropanoic acid

(2S)-3-fluoro-2-hydroxypropanoic acid

C3H5FO3 (108.0222712)


   

Chinone

2,5-Cyclohexadiene-1,4-dione, radical ion(1-)

C6H4O2 (108.0211284)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

NDR-132

4-01-00-02503 (Beilstein Handbook Reference)

C3H8S2 (108.0067408)


   
   

Methanediamine, 1-sulfonyl-

Methanediamine, 1-sulfonyl-

CH4N2O2S (107.9993484)


   
   

Ortho-benzosemiquinone

Ortho-benzosemiquinone

C6H4O2- (108.0211284)


   

1-(methylthio)ethanethiol

1-(methylthio)ethanethiol

C3H8S2 (108.0067408)


   

2-Aminoethanesulfinate

2-Aminoethanesulfinate

C2H6NO2S- (108.0119236)


   

Benzene-1,2-diolate

Benzene-1,2-diolate

C6H4O2-2 (108.0211284)


   

(Ethylsulfanyl)methanethiol

(Ethylsulfanyl)methanethiol

C3H8S2 (108.0067408)


   

(Hydroxymethyl)(methyl)silanediol

(Hydroxymethyl)(methyl)silanediol

C2H8O3Si (108.0242698)


   
   
   

1,4-Benzoquinone

1,4-Benzoquinone

C6H4O2 (108.0211284)


The simplest member of the class of 1,4-benzoquinones, obtained by the formal oxidation of hydroquinone to the corresponding diketone. It is a metabolite of benzene. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

1,2-Benzoquinone

1,2-Benzoquinone

C6H4O2 (108.0211284)


   
   

3-Mercaptopropane-1,2-diol

3-Mercaptopropane-1,2-diol

C3H8O2S (108.0244988)


   

1,3-Propanedithiol

1,3-Propanedithiol

C3H8S2 (108.0067408)


   

2,4-Dithiapentane

Bis(methylthio)methane

C3H8S2 (108.0067408)


   

4-chlorobutanol

4-chlorobutanol

C4H9ClO (108.03418940000002)


A primary alcohol that is butan-1-ol substituted by a chloro group at position 4.

   

2,2-Dihydroperoxypropane

2,2-Dihydroperoxypropane

C3H8O4 (108.0422568)


   

hypotaurine(1-)

hypotaurine(1-)

C2H6NO2S (108.0119236)


An organosulfinate oxoanion resulting from the deprotonation of the sulfinic acid group of hypotaurine.

   

catecholate(2-)

catecholate(2-)

C6H4O2 (108.0211284)


A phenolate anion that is the conjugate base of catecholate(1-).