Exact Mass: 227.02131480000003

Exact Mass Matches: 227.02131480000003

Found 66 metabolites which its exact mass value is equals to given mass value 227.02131480000003, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

2,4,6-Trinitrotoluene

2-methyl-1,3,5-trinitrobenzene

C7H5N3O6 (227.01783500000002)


Trinitrotoluene, also known as tnt or S-trinitrotoluol, is a member of the class of compounds known as nitrobenzenes. Nitrobenzenes are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group. Trinitrotoluene is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Trinitrotoluene can be found in a number of food items such as parsnip, broccoli, highbush blueberry, and sunburst squash (pattypan squash), which makes trinitrotoluene a potential biomarker for the consumption of these food products. Trinitrotoluene is formally rated as an unfounded non-carcinogenic (IARC 3) potentially toxic compound. Trinitrotoluene (; TNT), or more specifically 2,4,6-trinitrotoluene, is a chemical compound with the formula C6H2(NO2)3CH3. This yellow solid is sometimes used as a reagent in chemical synthesis, but it is best known as an explosive material with convenient handling properties. The explosive yield of TNT is considered to be the standard measure of bombs and other explosives. In chemistry, TNT is used to generate charge transfer salts . In some cases, gastric lavage, activated charcoal, and emetics have been suggested as useful in reducing absorption of the general class of nitro compounds to which 2,4,6-trinitrotoluene belongs (L132) (T3DB). CONFIDENCE standard compound; INTERNAL_ID 42 D053834 - Explosive Agents

   

L-Glutamic acid 5-phosphate

(2S)-2-Amino-5-oxo-5-(phosphonooxy)pentanoic acid

C5H10NO7P (227.019488)


L-Glutamic acid 5-phosphate is an intermediate in the urea cycle and the metabolism of amino groups. It is a substrate of aldehyde dehydrogenase 18 family, member A1 [EC:2.7.2.11 1.2.1.41] (KEGG)In citrulline biosynthesis, it is a substrate of the enzyme glutamate-5-semialdehyde dehydrogenase [EC 1.2.1.41] and in proline synthesis it is a substrate of the enzyme Glutamate 5-kinase [EC 2.7.2.11] (BioCyc). L-Glutamic acid 5-phosphate is an intermediate in the urea cycle and metabolism of amino groups, a substrate of aldehyde dehydrogenase 18 family, member A1 [EC:2.7.2.11 1.2.1.41] (KEGG)

   

alpha-glutamyl phosphate

α-D-Glutamyl phosphate

C5H10NO7P (227.019488)


   

alpha-L-glutamyl phosphate

alpha-L-glutamyl phosphate

C5H10NO7P (227.019488)


   

1-(3,4-Dichlorophenyl)-3-azabicyclo[3.1.0]hexane

1-(3,4-Dichlorophenyl)-3-azabicyclo[3.1.0]hexane

C11H11Cl2N (227.02685060000002)


   

2,3,4-Trinitrotoluene

1-methyl-2,3,4-trinitrobenzene

C7H5N3O6 (227.01783500000002)


   

6-Hydroxyindoxyl sulfate

(6-Methyl-1H-indol-3-yl)oxidanesulphonic acid

C9H9NO4S (227.0252274)


   

6-[(methoxythio)carbonyl]pyridine-2-carboxylic acid methyl ester

6-[(methoxythio)carbonyl]pyridine-2-carboxylic acid methyl ester

C9H9NO4S (227.0252274)


   

4-Bromo-2,6-diethylaniline

4-Bromo-2,6-diethylaniline

C10H14BrN (227.0309544)


   

Potassium (4-carbamoylphenyl)trifluoroborate

Potassium (4-carbamoylphenyl)trifluoroborate

C7H6BF3KNO (227.0131592)


   

N-(2-Bromobenzyl)-2-propanamine

N-(2-Bromobenzyl)-2-propanamine

C10H14BrN (227.0309544)


   

Acetic acid,2-[[(4-nitrophenyl)methyl]thio]-

Acetic acid,2-[[(4-nitrophenyl)methyl]thio]-

C9H9NO4S (227.0252274)


   

4-BROMO-N-ISOBUTYLANILINE

4-BROMO-N-ISOBUTYLANILINE

C10H14BrN (227.0309544)


   

METHYL 2-(METHYLTHIO)-5-NITROBENZOATE

METHYL 2-(METHYLTHIO)-5-NITROBENZOATE

C9H9NO4S (227.0252274)


   
   

3-bromo-N-butylaniline

3-bromo-N-butylaniline

C10H14BrN (227.0309544)


   

4-Bromo-N,N,2,6-tetramethylaniline

4-Bromo-N,N,2,6-tetramethylaniline

C10H14BrN (227.0309544)


   

quinolinium hydrogen sulphate

quinolinium hydrogen sulphate

C9H9NO4S (227.0252274)


   

(2E)-3-(4-ISOPROPOXY-3-METHOXYPHENYL)ACRYLICACID

(2E)-3-(4-ISOPROPOXY-3-METHOXYPHENYL)ACRYLICACID

C9H9NO4S (227.0252274)


   

(2R)-(-)-1-BENZOYL-2-TERT-BUTYL-3-METHYL-4-IMIDAZOLIDINONE

(2R)-(-)-1-BENZOYL-2-TERT-BUTYL-3-METHYL-4-IMIDAZOLIDINONE

C11H11Cl2N (227.02685060000002)


   

4-(1,2,3-THIADIAZOL-4-YL)BENZYLAMINE HYDROCHLORIDE

4-(1,2,3-THIADIAZOL-4-YL)BENZYLAMINE HYDROCHLORIDE

C9H10ClN3S (227.028393)


   

2-Amino-4,6-dinitrobenzoic acid

2-Amino-4,6-dinitrobenzoic acid

C7H5N3O6 (227.01783500000002)


   

4-Amino-2,6-dinitrobenzoic acid

4-Amino-2,6-dinitrobenzoic acid

C7H5N3O6 (227.01783500000002)


   

5-NITRO-2-(TRIFLUOROMETHYL)-1,2-DIHYDROPYRIMIDINE-4,6-DIOL

5-NITRO-2-(TRIFLUOROMETHYL)-1,2-DIHYDROPYRIMIDINE-4,6-DIOL

C5H4F3N3O4 (227.01539)


   

Quinoline sulfate (1:1)

Quinoline sulfate (1:1)

C9H9NO4S (227.0252274)


   

2-bromo-4-tert-butylaniline

2-bromo-4-tert-butylaniline

C10H14BrN (227.0309544)


   

trans-5-(4-Chlorophenyl)-4-methyl-2-thiazolidone

trans-5-(4-Chlorophenyl)-4-methyl-2-thiazolidone

C10H10ClNOS (227.01716)


   
   
   
   

N-(4-Bromobenzyl)-2-propanamine

N-(4-Bromobenzyl)-2-propanamine

C10H14BrN (227.0309544)


   

2-chloro-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone

2-chloro-1-(2,3-dihydro-1,4-benzothiazin-4-yl)ethanone

C10H10ClNOS (227.01716)


   

2-(2-amino-6-chloropurin-9-yl)acetic acid

2-(2-amino-6-chloropurin-9-yl)acetic acid

C7H6ClN5O2 (227.0210006)


   

N-(3-Bromobenzyl)-1-propanamine

N-(3-Bromobenzyl)-1-propanamine

C10H14BrN (227.0309544)


   

2-(2-CHLORO-ETHYL)-5-FLUORO-ISOINDOLE-1,3-DIONE

2-(2-CHLORO-ETHYL)-5-FLUORO-ISOINDOLE-1,3-DIONE

C10H7ClFNO2 (227.01493240000002)


   

Benzenamine,3-bromo-N,N-diethyl-

Benzenamine,3-bromo-N,N-diethyl-

C10H14BrN (227.0309544)


   

3-ethyl-6-methyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

3-ethyl-6-methyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

C8H9N3OS2 (227.0187024)


   

(3-chloro-2-fluoro-5-(trifluoromethyl)phenyl)methanamine

(3-chloro-2-fluoro-5-(trifluoromethyl)phenyl)methanamine

C8H6ClF4N (227.0124874)


   

2-BROMO-5-(TERT-BUTYL)ANILINE

2-BROMO-5-(TERT-BUTYL)ANILINE

C10H14BrN (227.0309544)


   

2-(4-Bromophenyl)-N,N-dimethylethanamine

2-(4-Bromophenyl)-N,N-dimethylethanamine

C10H14BrN (227.0309544)


   

Pyrrolidinium,1,1-dimethyl-, iodide (1:1)

Pyrrolidinium,1,1-dimethyl-, iodide (1:1)

C6H14IN (227.0170954)


   

4-Bromo-N,2-diethylaniline

4-Bromo-N,2-diethylaniline

C10H14BrN (227.0309544)


   

1-(4-bromophenyl)-2-methylpropan-2-amine

1-(4-bromophenyl)-2-methylpropan-2-amine

C10H14BrN (227.0309544)


   

4-(4-bromophenyl)butan-2-amine

4-(4-bromophenyl)butan-2-amine

C10H14BrN (227.0309544)


   
   
   
   

4-bromo-n,n-diethylaniline

4-bromo-n,n-diethylaniline

C10H14BrN (227.0309544)


   

POTASSIUM (2-CARBAMOYLPHENYL)TRIFLUOROBORATE

POTASSIUM (2-CARBAMOYLPHENYL)TRIFLUOROBORATE

C7H6BF3KNO (227.0131592)


   

methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate

methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate

C9H9NO4S (227.0252274)


   

Benzenemethanamine, 3-​bromo-​N,​N,​5-​trimethyl-

Benzenemethanamine, 3-​bromo-​N,​N,​5-​trimethyl-

C10H14BrN (227.0309544)


   

4-Bromo-N,N-dimethyl-3,5-xylidine

4-Bromo-N,N-dimethyl-3,5-xylidine

C10H14BrN (227.0309544)


   

Benzoic acid,4-amino-3,5-dinitro-

Benzoic acid,4-amino-3,5-dinitro-

C7H5N3O6 (227.01783500000002)


   

METHYL 5-(METHYLTHIO)-2-NITROBENZOATE

METHYL 5-(METHYLTHIO)-2-NITROBENZOATE

C9H9NO4S (227.0252274)


   

Methyl 5-chloro-4-fluoro-1H-indole-2-carboxylate

Methyl 5-chloro-4-fluoro-1H-indole-2-carboxylate

C10H7ClFNO2 (227.01493240000002)


   

Amitifadine

Amitifadine

C11H11Cl2N (227.02685060000002)


C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent

   

4,4-Dimethyl-3,4-dihydro-2H-1,2-benzoselenazine

4,4-Dimethyl-3,4-dihydro-2H-1,2-benzoselenazine

C10H13NSe (227.02131480000003)


   

6-Hydroxyindoxyl sulfate

6-Hydroxyindoxyl sulfate

C9H9NO4S (227.0252274)


   

N-(Carboxymethyl)-N-(phosphonomethyl)glycine

N-(Carboxymethyl)-N-(phosphonomethyl)glycine

C5H10NO7P (227.019488)


   

D-gamma-glutamyl phosphate

D-gamma-glutamyl phosphate

C5H10NO7P (227.019488)


   

7-Methoxy-3,5-dimethyl-2-thiazolo[4,5-d]pyrimidinethione

7-Methoxy-3,5-dimethyl-2-thiazolo[4,5-d]pyrimidinethione

C8H9N3OS2 (227.0187024)


   

gamma-Glutamyl phosphate

gamma-Glutamyl phosphate

C5H10NO7P (227.019488)


   

D-alpha-glutamyl phosphate

D-alpha-glutamyl phosphate

C5H10NO7P (227.019488)


   

Trinitrotoluene

2,4,6-TRINITROTOLUENE

C7H5N3O6 (227.01783500000002)


D053834 - Explosive Agents

   

5-Oxo-5-(phosphonooxy)norvaline

5-Oxo-5-(phosphonooxy)norvaline

C5H10NO7P (227.019488)


   

L-gamma-glutamyl phosphate

L-gamma-glutamyl phosphate

C5H10NO7P (227.019488)