Exact Mass: 112.0385

Exact Mass Matches: 112.0385

Found 64 metabolites which its exact mass value is equals to given mass value 112.0385, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

4-FLUOROPHENOL

4-FLUOROPHENOL

C6H5FO (112.0324)


   

2,3-Dimethylthiophene

2,3-Dimethyl-thiophene

C6H8S (112.0347)


   

2,5-Dimethylthiophene

2,5-Dimethyl-thiophene

C6H8S (112.0347)


2,5-Dimethylthiophene is found in garden onion. 2,5-Dimethylthiophene is an odorant used in food flavouring. Odorant used in food flavouring. 2,5-Dimethylthiophene is found in garden onion and soft-necked garlic.

   

2,4-Dimethylthiophene

thiophene, 2,4-dimethyl-

C6H8S (112.0347)


2,4-Dimethylthiophene is found in garden onion. 2,4-Dimethylthiophene is a constituent of Allium species. Also found in various cooked foods. 2,4-Dimethylthiophene is an odorant used in food flavouring. Constituent of Allium subspecies. Also found in various cooked foods. Odorant used in food flavouring.

   

2,3-Dimethylthiophene

thiophene, 2,3-dimethyl-

C6H8S (112.0347)


2,3-Dimethylthiophene is found in garden onion. 2,3-Dimethylthiophene is an odorant used in food flavouring. Odorant used in food flavouring. 2,3-Dimethylthiophene is found in garden onion.

   

3,4-Dimethylthiophene

3,4-Dimethyl-thiophene

C6H8S (112.0347)


3,4-Dimethylthiophene is found in garden onion. 3,4-Dimethylthiophene is an odorant used in food flavouring. Odorant used in food flavouring. 3,4-Dimethylthiophene is found in garden onion.

   

2-Ethylthiophene

2-Ethyl-thiophene

C6H8S (112.0347)


2-Ethylthiophene is found in animal foods. 2-Ethylthiophene is a maillard product; present in roast meat arom Maillard product; present in roast meat aroma. 2-Ethylthiophene is found in animal foods and guava.

   

3-Ethylthiophene

3-Ethyl-thiophene

C6H8S (112.0347)


3-Ethylthiophene is found in animal foods. 3-Ethylthiophene is a maillard product; present in roast meat arom Maillard product; present in roast meat aroma. 3-Ethylthiophene is found in animal foods.

   

1H-1,2,4-Triazole-3-carboxamide

1H-1,2,4-triazole-5-carboxamide

C3H4N4O (112.0385)


   

3-Methyl-2-cyclopentene-1-thione

3-Methyl-2-cyclopentene-1-thione

C6H8S (112.0347)


3-methyl-2-cyclopentene-1-thione is a member of the class of compounds known as thioketones. Thioketones are compounds in which the oxygen of a ketone has been replaced by divalent sulfur R2C=S ( R not H ). Thioketones that have an alpha-hydrogen interconvert with Thioenols. Moreover, they interconvert with thioaldehydes. 3-methyl-2-cyclopentene-1-thione is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 3-methyl-2-cyclopentene-1-thione can be found in soft-necked garlic, which makes 3-methyl-2-cyclopentene-1-thione a potential biomarker for the consumption of this food product.

   

2-methyl-2H-thiopyran

2-methyl-2H-thiopyran

C6H8S (112.0347)


   

1,2,4-Triazole-3-carboxamide

2H-1,2,4-Triazole-3-carboxamide

C3H4N4O (112.0385)


A member of the class of triazoles that is 1H-1,2,4-triazole substituted by an aminocarbonyl group at position 3. It is the major catabolite and aglycon of ribavirin.

   

2,4-Dimethylthiophene

2,4-Dimethyl-thiophene

C6H8S (112.0347)


   

2,5-DIMETHYLTHIOPHENE

2,5-Dimethyl-thiophene

C6H8S (112.0347)


   

3,4-Dimethylthiophene

3,4-Dimethyl-thiophene

C6H8S (112.0347)


A thiophene that is substituted by methyl groups at positions 3 and 4.

   

Histaminol

2-Ethyl-thiophene

C6H8S (112.0347)


   

3-Ethylthiophene

3-Ethyl-thiophene

C6H8S (112.0347)


   

Pyrimidine, 4-fluoro-2-methyl- (9CI)

Pyrimidine, 4-fluoro-2-methyl- (9CI)

C5H5FN2 (112.0437)


   

5-Amino-2-fluoropyridine

5-Amino-2-fluoropyridine

C5H5FN2 (112.0437)


   

1H-1,2,4-Triazole-1-carboxamide

1H-1,2,4-Triazole-1-carboxamide

C3H4N4O (112.0385)


   

5-azacytosine

5-azacytosine

C3H4N4O (112.0385)


   

3-Fluoro-4-pyridinamine

3-Fluoro-4-pyridinamine

C5H5FN2 (112.0437)


   

1H-Imidazol-4-ylboronic acid

1H-Imidazol-4-ylboronic acid

C3H5BN2O2 (112.0444)


   

1H-pyrazol-3-ylboronic acid

1H-pyrazol-3-ylboronic acid

C3H5BN2O2 (112.0444)


   

5-Fluoro-2-pyridineamine

5-Fluoro-2-pyridineamine

C5H5FN2 (112.0437)


   

(2H4)-2,5-Cyclohexadiene-1,4-dione

(2H4)-2,5-Cyclohexadiene-1,4-dione

C6D4O2 (112.0462)


   

5-fluoro-2-methylpyrimidine

5-fluoro-2-methylpyrimidine

C5H5FN2 (112.0437)


   

4-Fluoro-2-pyridinamine

4-Fluoro-2-pyridinamine

C5H5FN2 (112.0437)


   

1H-Pyrazol-4-ylboronic acid

1H-Pyrazol-4-ylboronic acid

C3H5BN2O2 (112.0444)


   

2-Fluoro-3-pyridinamine

2-Fluoro-3-pyridinamine

C5H5FN2 (112.0437)


   

2-Fluorophenol

2-Fluorophenol

C6H5FO (112.0324)


   

3-Fluorophenol

3-Fluorophenol

C6H5FO (112.0324)


   

3-Furylboronic acid

3-Furylboronic acid

C4H5BO3 (112.0332)


   

2-Furanboronic acid

2-Furanboronic acid

C4H5BO3 (112.0332)


   

Pyrimidine, 2-fluoro-5-methyl- (9CI)

Pyrimidine, 2-fluoro-5-methyl- (9CI)

C5H5FN2 (112.0437)


   

2-Amino-3-fluoropyridine

2-Amino-3-fluoropyridine

C5H5FN2 (112.0437)


   

4-fluoropyridin-3-amine

4-fluoropyridin-3-amine

C5H5FN2 (112.0437)


   

sodium,butane-1-thiolate

sodium,butane-1-thiolate

C4H9NaS (112.0323)


   

2-Fluoro-4-pyridinamine

2-Fluoro-4-pyridinamine

C5H5FN2 (112.0437)


   

6-Fluoro-2-pyridinamine

6-Fluoro-2-pyridinamine

C5H5FN2 (112.0437)


   

Sodium 2-methyl-2-propanethiolate

Sodium 2-methyl-2-propanethiolate

C4H9NaS (112.0323)


   

POTASSIUM SEC-BUTOXIDE

POTASSIUM SEC-BUTOXIDE

C4H9KO (112.029)


   

1H-imidazol-2-ylboronic acid

1H-imidazol-2-ylboronic acid

C3H5BN2O2 (112.0444)


   

Sodium trimethylsilanolate

Sodium trimethylsilanolate

C3H9NaOSi (112.032)


   

5-Fluoropyridin-3-amine

5-Fluoropyridin-3-amine

C5H5FN2 (112.0437)


   

potassium t-butoxide

potassium t-butoxide

C4H9KO (112.029)


   

5-Fluoro-3-pyridinamine

5-Fluoro-3-pyridinamine

C5H5FN2 (112.0437)


   

O-(2-aminoethyl)hydroxylamine,hydrochloride

O-(2-aminoethyl)hydroxylamine,hydrochloride

C2H9ClN2O (112.0403)


   

2H-1,2,4-Triazole-3-carboxamide

2H-1,2,4-Triazole-3-carboxamide

C3H4N4O (112.0385)


   

638-00-6

thiophene, 2,4-dimethyl-

C6H8S (112.0347)


   

1795-01-3

THIOPHENE, 3-ETHYL-

C6H8S (112.0347)


   

638-02-8

InChI=1\C6H8S\c1-5-3-4-6(2)7-5\h3-4H,1-2H

C6H8S (112.0347)


   

632-15-5

Thiophene, 3,4-dimethyl-

C6H8S (112.0347)


   

1-Pyrroline-2-carboxylate

1-Pyrroline-2-carboxylate

C5H6NO2- (112.0399)


The anion resulting from the removal of a proton from the carboxylic acid group of 1-pyrroline-2-carboxylic acid.

   

3,4-Dihydro-2H-Pyrrole-2-carboxylate

3,4-Dihydro-2H-Pyrrole-2-carboxylate

C5H6NO2- (112.0399)


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

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

C5H6NO2- (112.0399)


   

2-Amino-2,4-penta-dienoate

2-Amino-2,4-penta-dienoate

C5H6NO2- (112.0399)


   

(R)-1-pyrroline-5-carboxylate

(R)-1-pyrroline-5-carboxylate

C5H6NO2- (112.0399)


A 1-pyrroline-5-carboxylate resulting from the removal of the proton from the carboxy group of (R)-1-pyrroline-5-carboxylic acid.

   

(2S)-2-(ethynylamino)propanoate

(2S)-2-(ethynylamino)propanoate

C5H6NO2- (112.0399)


   

(3R)-3-isocyanylbutanoate

(3R)-3-isocyanylbutanoate

C5H6NO2- (112.0399)


   

(S)-1-Pyrroline-5-carboxylate

(S)-1-Pyrroline-5-carboxylate

C5H6NO2 (112.0399)


A 1-pyrroline-5-carboxylate resulting from the removal of the proton from the carboxy group of (S)-1-pyrroline-5-carboxylic acid.

   

1-Pyrroline-5-carboxylate

1-Pyrroline-5-carboxylate

C5H6NO2 (112.0399)


A 1-pyrrolinecarboxylate resulting from the removal of the proton from the carboxy group of 1-pyrroline-5-carboxylic acid.

   

Dimethylthiophene

Dimethylthiophene

C6H8S (112.0347)


   

1-propenyl-1-propynyl sulfide

NA

C6H8S (112.0347)


{"Ingredient_id": "HBIN002999","Ingredient_name": "1-propenyl-1-propynyl sulfide","Alias": "NA","Ingredient_formula": "C6H8S","Ingredient_Smile": "CC=CSC#CC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34676","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}