Exact Mass: 128.0249112

Exact Mass Matches: 128.0249112

Found 93 metabolites which its exact mass value is equals to given mass value 128.0249112, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Ammelide

6-Amino-1,3,5-triazine-2,4(1H,3H)-dione

C3H4N4O2 (128.0334244)


CONFIDENCE standard compound; UCHEM_ID 4186

   

Barbituric acid

2,4,6(1H,3H,5H)-Pyrimidinetrione (acd/name 4.0)

C4H4N2O3 (128.0221914)


Barbituric acid or malonylurea or 6-hydroxyuracil is an organic compound based on a pyrimidine heterocyclic skeleton. It is an odorless powder soluble in water. Barbituric acid is the parent compound of barbiturate drugs, although barbituric acid itself is not pharmacologically active. The compound was discovered by the German chemist Adolf von Baeyer on December 4, 1864, the feast of Saint Barbara (who gave the compound its namesake), by combining urea and malonic acid in a condensation reaction. Malonic acid has since been replaced by diethyl malonate, as using the ester avoids the problem of having to deal with the acidity of the carboxylic acid and its unreactive carboxylate.

   

1-Methylparabanic acid

1-methylimidazolidine-2,4,5-trione

C4H4N2O3 (128.0221914)


   

3-Fluorocatechol

3-Fluorocatechol

C6H5FO2 (128.0273562)


A catechol bearing an additional fluoro substituent at position 3.

   

4-Fluorocatechol

4-Fluorocatechol

C6H5FO2 (128.0273562)


   

2,5-Dimethyl-3-furanthiol

3-mercapto-2,5-Dimethylfuran

C6H8OS (128.0295838)


2,5-Dimethyl-3-furanthiol is found in animal foods. 2,5-Dimethyl-3-furanthiol is a component of chicken volatiles. 2,5-Dimethyl-3-furanthiol is a flavouring agent. Component of chicken volatiles. Flavouring agent. 2,5-Dimethyl-3-furanthiol is found in animal foods.

   

2-(Methylthiomethyl)furan

2-[(Methylsulphanyl)methyl]furan

C6H8OS (128.0295838)


2-(Methylthiomethyl)furan, also known as 2-furfuryl methyl sulfide or fema 3160, belongs to the class of organic compounds known as heteroaromatic compounds. Heteroaromatic compounds are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom. 2-(Methylthiomethyl)furan is a garlic, horseradish, and onion tasting compound. 2-(methylthiomethyl)furan has been detected, but not quantified, in coffee and coffee products. This could make 2-(methylthiomethyl)furan a potential biomarker for the consumption of these foods. Minor constituent of aroma of coffee, also present in smoked cured pork and pork liver. Flavour ingredient. 2-(Methylthiomethyl)furan is found in coffee and coffee products and animal foods.

   

2-Methyl-3-(methylthio)furan

2-Methyl-3-(methylsulphanyl)furan

C6H8OS (128.0295838)


2-Methyl-3-(methylthio)furan is found in animal foods. 2-Methyl-3-(methylthio)furan occurs in coffee and cooked beef aromas. 2-Methyl-3-(methylthio)furan is a compound with intense roasted meat aroma. Occurs in coffee and cooked beef aromas. Compd. with intense roasted meat aroma. 2-Methyl-3-(methylthio)furan is found in coffee and coffee products and animal foods.

   

2-(1-Mercaptoethyl)furan

3-beta-D-Ribofuranosyl-3H-purin-6-amine

C6H8OS (128.0295838)


Cysteine/cystine-derived Maillard product, present in model meat aroma systems. Cysteine/cystine-derived Maillard product, present in model meat aroma systems

   

5-Methyl-2-furanmethanethiol

(5-methylfuran-2-yl)methanethiol

C6H8OS (128.0295838)


Cysteine-derived Maillard product. Constituent of coffee, roasted sesame and yeast-extract volatiles. 5-Methyl-2-furanmethanethiol is found in mushrooms, cereals and cereal products, and coffee and coffee products. 5-Methyl-2-furanmethanethiol is found in cereals and cereal products. Cysteine-derived Maillard product. 5-Methyl-2-furanmethanethiol is a constituent of coffee, roasted sesame and yeast-extract volatiles.

   

2-Methyl-5-(methylthio)furan

2-Methyl-5-(methylthio)furan, 9ci

C6H8OS (128.0295838)


2-Methyl-5-(methylthio)furan is found in coffee and coffee products. 2-Methyl-5-(methylthio)furan is a constituent of roasted coffee aroma. 2-Methyl-5-(methylthio)furan is a flavouring agent. Constituent of roasted coffee aroma. Flavouring agent. 2-Methyl-5-(methylthio)furan is found in coffee and coffee products.

   

Pyrimidine-2,4,6-triol

6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

C4H4N2O3 (128.0221914)


   

5-Hydroxyuracil

5-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

C4H4N2O3 (128.0221914)


5-hydroxyuracil, also known as dihydropyrimidine-2,4,5(3h)-trione or isobarbituric acid, is a member of the class of compounds known as hydroxypyrimidines. Hydroxypyrimidines are organic compounds containing a hydroxyl group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions. 5-hydroxyuracil is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 5-hydroxyuracil can be found in broad bean, which makes 5-hydroxyuracil a potential biomarker for the consumption of this food product. 5-hydroxyuracil is an oxidized form of cytosine that is produced by the oxidative deamination of cytosines by reactive oxygen species. It does not distort the DNA molecule and is bypassed by replicative DNA polymerases. It can miscode for adenine and is potentially mutagenic .

   

4-Oxoproline

4-Oxopyrrolidine-2-carboxylate

C5H6NO3 (128.0347666)


   
   

Non-2t-en-4,6,8-triinal|non-2t-ene-4,6,8-triynal

Non-2t-en-4,6,8-triinal|non-2t-ene-4,6,8-triynal

C9H4O (128.0262134)


   

2-oxo-2,3-dihydro-1H-imidazole-4-carboxylic acid

2-oxo-2,3-dihydro-1H-imidazole-4-carboxylic acid

C4H4N2O3 (128.0221914)


   
   

2-nonene-4,6,8-triynal

2-nonene-4,6,8-triynal

C9H4O (128.0262134)


An enynal that is nonenal with a double bond at position 2 and triple bonds at positions 4, 6, and 8.

   

FEMA 3160

2-[(Methylsulfanyl)methyl]furan

C6H8OS (128.0295838)


   

Dimethylthiofuran

2-methyl-3-(methylsulfanyl)furan

C6H8OS (128.0295838)


   

3-Isoadenosine

3-beta-D-Ribofuranosyl-3H-purin-6-amine

C6H8OS (128.0295838)


   

methyl furfuryl thiol

(5-methylfuran-2-yl)methanethiol

C6H8OS (128.0295838)


   

FEMA 3451

3-mercapto-2,5-Dimethylfuran

C6H8OS (128.0295838)


   

FEMA 3366

2-Methyl-5-(methylthio)furan, 9ci

C6H8OS (128.0295838)


   

FAL 9:7

2-nonene-4,6,8-triynal

C9H4O (128.0262134)


   

1-(thiophen-3-yl)ethanol

1-(thiophen-3-yl)ethanol

C6H8OS (128.0295838)


   

2-CYANO-2-(METHOXYIMINO)ACETIC ACID

2-CYANO-2-(METHOXYIMINO)ACETIC ACID

C4H4N2O3 (128.0221914)


   

Magnesium,chlorocyclopentyl-

Magnesium,chlorocyclopentyl-

C5H9ClMg (128.0243244)


   

2H-triazole-4-carbothioamide

2H-triazole-4-carbothioamide

C3H4N4S (128.0156664)


   

2-Fluoro-1,3-benzenediol

2-Fluoro-1,3-benzenediol

C6H5FO2 (128.0273562)


   

1-(2-Thienyl)ethanol

1-(2-Thienyl)ethanol

C6H8OS (128.0295838)


   
   

piperazine-2,3,5-trione

piperazine-2,3,5-trione

C4H4N2O3 (128.0221914)


   

6-HYDROXYURACIL

Pyrimidine-2,4,6-triol

C4H4N2O3 (128.0221914)


   

2-Thiopheneethanol

2-Thiopheneethanol

C6H8OS (128.0295838)


   

2,4,4,4-TETRAFLUORO-1-BUTENE

2,4,4,4-TETRAFLUORO-1-BUTENE

C4H4F4 (128.0249112)


   

2-Aminooxazole-5-carboxylic acid

2-Aminooxazole-5-carboxylic acid

C4H4N2O3 (128.0221914)


   

5,6-Dihydro-2H-thiopyran-3-carbaldehyde

5,6-Dihydro-2H-thiopyran-3-carbaldehyde

C6H8OS (128.0295838)


   

5-Methoxymethyl-thiophene

5-Methoxymethyl-thiophene

C6H8OS (128.0295838)


   

1-methyl-5-nitro-1H-1,2,3-triazole

1-methyl-5-nitro-1H-1,2,3-triazole

C3H4N4O2 (128.0334244)


   

5-Methyl-1,3,4-oxadiazole-2-carboxylic acid

5-Methyl-1,3,4-oxadiazole-2-carboxylic acid

C4H4N2O3 (128.0221914)


   

5-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID

5-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID

C4H4N2O3 (128.0221914)


   

2-methoxy-5-methylthiophene

2-methoxy-5-methylthiophene

C6H8OS (128.0295838)


   

(4-methylthiophen-2-yl)methanol

(4-methylthiophen-2-yl)methanol

C6H8OS (128.0295838)


   

4-Amino-3-furazanecarboxamide

4-Amino-3-furazanecarboxamide

C3H4N4O2 (128.0334244)


   

RARECHEM AL BD 0181

RARECHEM AL BD 0181

C6H8OS (128.0295838)


   

1H-Imidazol-4-amine,5-nitro-(9CI)

1H-Imidazol-4-amine,5-nitro-(9CI)

C3H4N4O2 (128.0334244)


   

2-(3-Thienyl)ethanol

2-(3-Thienyl)ethanol

C6H8OS (128.0295838)


   

(4-CHLORO-PYRIMIDIN-2-YL)-ETHYL-AMINE

(4-CHLORO-PYRIMIDIN-2-YL)-ETHYL-AMINE

C6H8OS (128.0295838)


   

5-METHYL-4-NITROISOXAZOLE

5-METHYL-4-NITROISOXAZOLE

C4H4N2O3 (128.0221914)


   

1H-1,2,4-Triazole-3-carboxylicacid,1-amino-

1H-1,2,4-Triazole-3-carboxylicacid,1-amino-

C3H4N4O2 (128.0334244)


   

2-Thiophenemethanol, 3-methyl-

2-Thiophenemethanol, 3-methyl-

C6H8OS (128.0295838)


   
   

1H-1,2,4-Triazole,1-methyl-3-nitro-(8CI,9CI)

1H-1,2,4-Triazole,1-methyl-3-nitro-(8CI,9CI)

C3H4N4O2 (128.0334244)


   

2H-TETRAZOLE-2-ACETIC ACID

2H-TETRAZOLE-2-ACETIC ACID

C3H4N4O2 (128.0334244)


   

2-Fluorobenzene-1,4-diol

2-Fluorobenzene-1,4-diol

C6H5FO2 (128.0273562)


   

Amino-5,6-dihydro-1,3,5-triazine-2(1H)-thione

Amino-5,6-dihydro-1,3,5-triazine-2(1H)-thione

C3H4N4S (128.0156664)


   

2-Amino-1,3-oxazole-4-carboxylic acid

2-Amino-1,3-oxazole-4-carboxylic acid

C4H4N2O3 (128.0221914)


   
   

6-amino-1H-1,3,5-triazine-2,4-dione

6-amino-1H-1,3,5-triazine-2,4-dione

C3H4N4O2 (128.0334244)


   

3-Amino-1,2-oxazole-5-carboxylic acid

3-Amino-1,2-oxazole-5-carboxylic acid

C4H4N2O3 (128.0221914)


   

3-Amino-1H-1,2,4-triazole-5-carboxylic acid

3-Amino-1H-1,2,4-triazole-5-carboxylic acid

C3H4N4O2 (128.0334244)


   

1,2,4-oxadiazole-3-carbohydrazide

1,2,4-oxadiazole-3-carbohydrazide

C3H4N4O2 (128.0334244)


   

(1S)-1-(2-THIENYL)ETHANOL

(1S)-1-(2-THIENYL)ETHANOL

C6H8OS (128.0295838)


   

(1r)-1-(2-thienyl)ethanol

(1r)-1-(2-thienyl)ethanol

C6H8OS (128.0295838)


   

3-Oxo-2,3-dihydro-1H-pyrazole-4-carboxylic acid

3-Oxo-2,3-dihydro-1H-pyrazole-4-carboxylic acid

C4H4N2O3 (128.0221914)


   

2-methoxy-4-methylthiophene

2-methoxy-4-methylthiophene

C6H8OS (128.0295838)


   

4-nitro-1H-pyrazol-5-amine

4-nitro-1H-pyrazol-5-amine

C3H4N4O2 (128.0334244)


   

1H-Imidazole-2-carboxaldehyde, 1-hydroxy-, 3-oxide (9CI)

1H-Imidazole-2-carboxaldehyde, 1-hydroxy-, 3-oxide (9CI)

C4H4N2O3 (128.0221914)


   

1H-Tetrazole-1-acetic acid

1H-Tetrazole-1-acetic acid

C3H4N4O2 (128.0334244)


   

5-Methyl-1,2,4-oxadiazole-3-carboxylic acid

5-Methyl-1,2,4-oxadiazole-3-carboxylic acid

C4H4N2O3 (128.0221914)


   

1H-Pyrazol-4-amine,3-nitro-(9CI)

1H-Pyrazol-4-amine,3-nitro-(9CI)

C3H4N4O2 (128.0334244)


   

1H-Imidazole-2-carboxylic acid,4,5-dihydro-5-oxo-

1H-Imidazole-2-carboxylic acid,4,5-dihydro-5-oxo-

C4H4N2O3 (128.0221914)


   

1H-Tetrazol-5-ylacetic acid

1H-Tetrazol-5-ylacetic acid

C3H4N4O2 (128.0334244)


   

4-Fluororesorcinol

4-Fluororesorcinol

C6H5FO2 (128.0273562)


   

4-methyl-1,2,5-oxadiazole-3-carboxylic acid

4-methyl-1,2,5-oxadiazole-3-carboxylic acid

C4H4N2O3 (128.0221914)


   

5-Oxo-l-prolinate

5-Oxo-l-prolinate

C5H6NO3- (128.0347666)


Conjugate base of 5-oxo-L-proline.

   

5-oxo-D-prolinate

5-oxo-D-prolinate

C5H6NO3- (128.0347666)


The conjugate base of 5-oxo-D-proline; major species at pH 7.3.

   

4-Hydroxy-1-pyrroline-2-carboxylate

4-Hydroxy-1-pyrroline-2-carboxylate

C5H6NO3- (128.0347666)


The conjugate base of 4-hydroxy-1-pyrroline-2-carboxylic acid; major species at pH 7.3.

   

(2S,4R)-4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate

(2S,4R)-4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate

C5H6NO3- (128.0347666)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Trihydroxypyrazine

Trihydroxypyrazine

C4H4N2O3 (128.0221914)


   

4-oxoprolinate

4-oxoprolinate

C5H6NO3- (128.0347666)


Conjugate base of 4-oxoproline.

   

5-Oxoprolinate

5-Oxoprolinate

C5H6NO3- (128.0347666)


COVID info from COVID-19 Disease Map The conjugate base of 5-oxoproline. Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

1-Pyrroline-3-hydroxy-5-carboxylate

1-Pyrroline-3-hydroxy-5-carboxylate

C5H6NO3- (128.0347666)


Conjugate base of 1-pyrroline-3-hydroxy-5-carboxylic acid.

   

2-(Chloromethyl)pyridinium

2-(Chloromethyl)pyridinium

C6H7ClN+ (128.0266992)


   

(S)-4-hydroxy-1-pyrroline-2-carboxylate

(S)-4-hydroxy-1-pyrroline-2-carboxylate

C5H6NO3- (128.0347666)


A 1-pyrrolinecarboxylate that is the conjugate base of (S)-3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid, obtained by deprotonation of the carboxy group. Major species at pH 7.3.

   

1-Nitro-1,2-dihydro-1,3,5-triazine

1-Nitro-1,2-dihydro-1,3,5-triazine

C3H4N4O2 (128.0334244)


   
   
   

5-methyl-2-(methylthio)furan

5-methyl-2-(methylthio)furan

C6H8OS (128.0295838)


A member of the class of furans that is furan substituted by methyl and methylsulfanyl groups at positions 2 and 5, respectively. It is a metabolite found in coffee and human urine.

   

(3R,5S)-1-Pyrroline-3-hydroxy-5-carboxylate

(3R,5S)-1-Pyrroline-3-hydroxy-5-carboxylate

C5H6NO3 (128.0347666)


The 1-pyrrolinecarboxylate formed by deprotonation of the carboxy group of (3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid; principal microspecies at pH 7.3.

   

1,4-dihydroxypyrimidin-2-one

1,4-dihydroxypyrimidin-2-one

C4H4N2O3 (128.0221914)