Exact Mass: 232.0122962

Exact Mass Matches: 232.0122962

Found 97 metabolites which its exact mass value is equals to given mass value 232.0122962, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Diuron

3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff

C9H10Cl2N2O (232.01701500000001)


CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8771; ORIGINAL_PRECURSOR_SCAN_NO 8769 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8779; ORIGINAL_PRECURSOR_SCAN_NO 8777 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4215; ORIGINAL_PRECURSOR_SCAN_NO 4212 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4187; ORIGINAL_PRECURSOR_SCAN_NO 4185 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8742; ORIGINAL_PRECURSOR_SCAN_NO 8740 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8757; ORIGINAL_PRECURSOR_SCAN_NO 8755 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4217; ORIGINAL_PRECURSOR_SCAN_NO 4215 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4206; ORIGINAL_PRECURSOR_SCAN_NO 4202 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4204; ORIGINAL_PRECURSOR_SCAN_NO 4202 DATASET 20200303_ENTACT_RP_MIX504; CONFIDENCE standard compound; INTERNAL_ID 1200; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4215; ORIGINAL_PRECURSOR_SCAN_NO 4212 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4216; ORIGINAL_PRECURSOR_SCAN_NO 4214 ORIGINAL_PRECURSOR_SCAN_NO 8769; CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8771 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8744; ORIGINAL_PRECURSOR_SCAN_NO 8740 CONFIDENCE standard compound; INTERNAL_ID 1200; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8778; ORIGINAL_PRECURSOR_SCAN_NO 8776 CONFIDENCE standard compound; INTERNAL_ID 4004 CONFIDENCE standard compound; INTERNAL_ID 2412 CONFIDENCE standard compound; INTERNAL_ID 8777 CONFIDENCE standard compound; INTERNAL_ID 3410 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   
   

Chrycolide

7-hydroxy-3-(thiophen-2-yl)-1,3-dihydro-2-benzofuran-1-one

C12H8O3S (232.0194138)


Chrycolide is found in herbs and spices. Chrycolide is isolated from Chrysanthemum coronarium (chop-suey greens) whole plan Isolated from Chrysanthemum coronarium (chop-suey greens) whole plant. Chrycolide is found in herbs and spices.

   

2,4-Dihydroxyacetophenone 5-sulfate

(2-Acetyl-5-hydroxyphenyl)oxidanesulphonic acid

C8H8O6S (232.0041588)


2,4-Dihydroxyacetophenone 5-sulfate is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

Vanillin 4-sulfate

(4-Formyl-2-methoxyphenyl)oxidanesulphonic acid

C8H8O6S (232.0041588)


Vanillin 4-sulfate is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

2-[3-(sulfooxy)phenyl]acetic acid

2-[3-(Sulphooxy)phenyl]acetic acid

C8H8O6S (232.0041588)


2-[3-(sulfooxy)phenyl]acetic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2-(3-hydroxyphenyl)acetic acid. It is generated by Sulfotransferase 1A3 (P0DMM9) and Sulfotransferase enzymes via a -3-O-sulfation-of-phenolic-compound reaction. This -3-O-sulfation-of-phenolic-compound occurs in humans.

   

2-[4-(sulfooxy)phenyl]acetic acid

2-[4-(Sulphooxy)phenyl]acetic acid

C8H8O6S (232.0041588)


2-[4-(sulfooxy)phenyl]acetic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2-(4-hydroxyphenyl)acetic acid. It is generated by Sulfotransferase 1A3 (P0DMM9) and Sulfotransferase enzymes via a -4-O-sulfation-of-phenolic-compound reaction. This -4-O-sulfation-of-phenolic-compound occurs in humans.

   

Methyl-4-hydroxybenzoate sulfate

[4-(methoxycarbonyl)phenyl]oxidanesulfonic acid

C8H8O6S (232.0041588)


Methyl-4-hydroxybenzoate sulfate belongs to the class of organic compounds known as phenylsulfates. Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. Methyl-4-hydroxybenzoate sulfate has been identified in the human placenta (PMID: 32033212).

   

2-Hydroxyphenylacetic acid sulfate

2-Hydroxyphenylacetic acid sulphuric acid

C8H8O6S (232.0041588)


   

Phosphovanillin

(4-formyl-2-methoxyphenoxy)phosphonic acid

C8H9O6P (232.01367439999999)


   

4-Hydroxyphenylacetic acid sulfate

4-Hydroxyphenylacetic acid sulphuric acid

C8H8O6S (232.0041588)


   
   

(3,6-Dioxo-[1,4]dioxan-2,5-diyl)-di-essigsaeure|(3,6-dioxo-[1,4]dioxane-2,5-diyl)-di-acetic acid

(3,6-Dioxo-[1,4]dioxan-2,5-diyl)-di-essigsaeure|(3,6-dioxo-[1,4]dioxane-2,5-diyl)-di-acetic acid

C8H8O8 (232.02191679999999)


   
   

1-O-Sulfate-2,3-Dihydro-1,6-dihydroxyimidazo[1,5-alphaa]pyridine

1-O-Sulfate-2,3-Dihydro-1,6-dihydroxyimidazo[1,5-alphaa]pyridine

C7H8N2O5S (232.0153918)


   
   

3-Chloro-4,6-dimethoxysalicylic acid

3-Chloro-4,6-dimethoxysalicylic acid

C9H9ClO5 (232.01384940000003)


   

5-fluoro-5-deoxy-D-ribulose 1-phosphate

5-fluoro-5-deoxy-D-ribulose 1-phosphate

C5H10FO7P (232.0148172)


   

5-fluoro-5-deoxy-D-ribose 1-phosphate

5-fluoro-5-deoxy-D-ribose 1-phosphate

C5H10FO7P (232.0148172)


   

diuron

Pesticide3_Diuron_C9H10Cl2N2O_3-(3,4-Dichlorophenyl)-1,1-dimethylurea

C9H10Cl2N2O (232.01701500000001)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals CONFIDENCE standard compound; EAWAG_UCHEM_ID 292

   

Vanillin-4-sulfate

Vanillin-4-sulfate

C8H8O6S (232.0041588)


   

Mandelic acid sulfate

Mandelic acid sulfate

C8H8O6S (232.0041588)


   

3-Hydroxyphenylaceitic acid sulfate

3-Hydroxyphenylaceitic acid sulfate

C8H8O6S (232.0041588)


   

Chrycolide

7-hydroxy-3-(thiophen-2-yl)-1,3-dihydro-2-benzofuran-1-one

C12H8O3S (232.0194138)


   

2,4-Dihydroxyacetophenone 5-sulfate

(2-acetyl-5-hydroxyphenyl)oxidanesulfonic acid

C8H8O6S (232.0041588)


   

1-Fluoro-3,5-bis(trifluoromethyl)benzene

1-Fluoro-3,5-bis(trifluoromethyl)benzene

C8H3F7 (232.0122962)


   

Phenol, 2,4-dichloro-3,5-dimethyl-, 1-acetate

Phenol, 2,4-dichloro-3,5-dimethyl-, 1-acetate

C10H10Cl2O2 (232.00578200000004)


   

3-Benzoyl-2-thiophenecarboxylic acid

3-Benzoyl-2-thiophenecarboxylic acid

C12H8O3S (232.0194138)


   

Potassium trifluoro(3-fluoro-4-methoxyphenyl)borate

Potassium trifluoro(3-fluoro-4-methoxyphenyl)borate

C7H6BF4KO (232.00848839999998)


   

4-hydroxy-N-methyl-3-nitrobenzenesulphonamide

4-hydroxy-N-methyl-3-nitrobenzenesulphonamide

C7H8N2O5S (232.0153918)


   

3,5-BIS-CHLOROMETHYL-4-METHYL-BENZOIC ACID

3,5-BIS-CHLOROMETHYL-4-METHYL-BENZOIC ACID

C10H10Cl2O2 (232.00578200000004)


   
   

2,2-Dichlorophenylacetic acid ethyl ester

2,2-Dichlorophenylacetic acid ethyl ester

C10H10Cl2O2 (232.00578200000004)


   

2-(4-Chlorophenoxy)-2-methylpropanoyl chloride

2-(4-Chlorophenoxy)-2-methylpropanoyl chloride

C10H10Cl2O2 (232.00578200000004)


   

N1-(5-CHLORO-4-FLUORO-2-NITROPHENYL)ACETAMIDE

N1-(5-CHLORO-4-FLUORO-2-NITROPHENYL)ACETAMIDE

C8H6ClFN2O3 (232.00509680000002)


   

ETHYL 5-CHLORO-2-(METHYLTHIO)PYRIMIDINE-4-CARBOXYLATE

ETHYL 5-CHLORO-2-(METHYLTHIO)PYRIMIDINE-4-CARBOXYLATE

C8H9ClN2O2S (232.00732440000002)


   

1,3-Propanediol,1,3-dimethanesulfonate

1,3-Propanediol,1,3-dimethanesulfonate

C5H12O6S2 (232.0075292)


   

2-Nitro-5-(trifluoromethoxy)benzonitrile

2-Nitro-5-(trifluoromethoxy)benzonitrile

C8H3F3N2O3 (232.0095764)


   

2-Chloro-N-(2-fluoro-5-nitrophenyl)acetamide

2-Chloro-N-(2-fluoro-5-nitrophenyl)acetamide

C8H6ClFN2O3 (232.00509680000002)


   
   

(2-Chloro-4-fluoro-5-(methoxycarbonyl)phenyl)boronic acid

(2-Chloro-4-fluoro-5-(methoxycarbonyl)phenyl)boronic acid

C8H7BClFO4 (232.0109934)


   

Benzeneacetic acid,2,4-dichloro-, ethyl ester

Benzeneacetic acid,2,4-dichloro-, ethyl ester

C10H10Cl2O2 (232.00578200000004)


   

Magnesium citrate, dibasic hydrate

Magnesium citrate, dibasic hydrate

C6H8MgO8 (232.0069668)


   

2-chloro-6-(4-fluorophenyl)nicotinonitrile

2-chloro-6-(4-fluorophenyl)nicotinonitrile

C12H6ClFN2 (232.02035180000001)


   

3-(BENZO[D]THIAZOL-2-YL)THIOPHEN-2-AMINE

3-(BENZO[D]THIAZOL-2-YL)THIOPHEN-2-AMINE

C11H8N2S2 (232.01288879999998)


   

7-Chloro-3,4-dihydro-3-methyl-2H-1,2,4-benzothiadiazine 1,1-dioxide

7-Chloro-3,4-dihydro-3-methyl-2H-1,2,4-benzothiadiazine 1,1-dioxide

C8H9ClN2O2S (232.00732440000002)


IDRA 21 is a positive and orally active modulator of the AMPA receptor. IDRA 21 facilitates excitatory neurotransmission via GluR1/2 receptors. IDRA 21 has the potential for the research of cognitive/memory disorders, including those associated with aging[1].

   

4-amino-5-methyl-2-nitrobenzenesulfonic acid

4-amino-5-methyl-2-nitrobenzenesulfonic acid

C7H8N2O5S (232.0153918)


   

6-amino-3-methyl-2-nitrobenzenesulfonic acid

6-amino-3-methyl-2-nitrobenzenesulfonic acid

C7H8N2O5S (232.0153918)


   

3-(Imidazo[2,1-b]thiazol-6-yl)propanoic acid hydrochloride

3-(Imidazo[2,1-b]thiazol-6-yl)propanoic acid hydrochloride

C8H9ClN2O2S (232.00732440000002)


   

4(3H)-Pyrimidinone,2,6-bis(trifluoromethyl)-

4(3H)-Pyrimidinone,2,6-bis(trifluoromethyl)-

C6H2F6N2O (232.0071314)


   

Methyl 3-Fluoro-4-(methylsulfonyl)benzoate

Methyl 3-Fluoro-4-(methylsulfonyl)benzoate

C9H9FO4S (232.0205566)


   

6,7-Bis(chloromethyl)-2,3-dihydro-1,4-benzodioxin

6,7-Bis(chloromethyl)-2,3-dihydro-1,4-benzodioxin

C10H10Cl2O2 (232.00578200000004)


   

2,2,3,3,4,4,5,5-Octafluoro-1-pentanol

2,2,3,3,4,4,5,5-Octafluoro-1-pentanol

C5H4F8O (232.01343899999998)


   

4-NITRO-2-(TRIFLUOROMETHYL)PHENYL ISOCY&

4-NITRO-2-(TRIFLUOROMETHYL)PHENYL ISOCY&

C8H3F3N2O3 (232.0095764)


   

disodium dl-malate trihydrate

disodium dl-malate trihydrate

C4H10Na2O8 (232.017106)


   
   

Disodium tartrate dihydrate

Disodium tartrate dihydrate

C4H10Na2O8 (232.017106)


Tartaric acid disodium dihydrate is a Acid phosphatase inhibitor, is a sodium salt used in buffers for molecular biology and cell culture applications. Increases the rate of colchicine binding to tubulin1.

   

3-(2,3-dichlorophenyl)-1,1-dimethylurea

3-(2,3-dichlorophenyl)-1,1-dimethylurea

C9H10Cl2N2O (232.01701500000001)


   
   

Benzoic acid,2-(2-thienylcarbonyl)-

Benzoic acid,2-(2-thienylcarbonyl)-

C12H8O3S (232.0194138)


   

(4-FLUORO-PHENYL)-OXO-ACETALDEHYDE

(4-FLUORO-PHENYL)-OXO-ACETALDEHYDE

C9H9FO4S (232.0205566)


   

4-(4,6-dichloropyridin-2-yl)morpholine

4-(4,6-dichloropyridin-2-yl)morpholine

C9H10Cl2N2O (232.01701500000001)


   

4-(2,6-dichloropyridin-4-yl)morpholine

4-(2,6-dichloropyridin-4-yl)morpholine

C9H10Cl2N2O (232.01701500000001)


   

2,4-BIS(TRIFLUOROMETHYL)FLUOROBENZENE

2,4-BIS(TRIFLUOROMETHYL)FLUOROBENZENE

C8H3F7 (232.0122962)


   

3,5-Dimethyl-2,6-bis(methylthio)-4H-thiopyran-4-one

3,5-Dimethyl-2,6-bis(methylthio)-4H-thiopyran-4-one

C9H12OS3 (232.00502619999997)


   

2-NITRO-4-(TRIFLUOROMETHYL)PHENYL ISOCY&

2-NITRO-4-(TRIFLUOROMETHYL)PHENYL ISOCY&

C8H3F3N2O3 (232.0095764)


   

2-[methylsulfanyl(phenylsulfanyl)methylidene]propanedinitrile

2-[methylsulfanyl(phenylsulfanyl)methylidene]propanedinitrile

C11H8N2S2 (232.01288879999998)


   

Dimethyl 3,4-dihydroxy-2,5-thiophenedicarboxylate

Dimethyl 3,4-dihydroxy-2,5-thiophenedicarboxylate

C8H8O6S (232.0041588)


   

Ethyl 4-chloro-2-Methylthio-5-pyriMidinecarboxylate

Ethyl 4-chloro-2-Methylthio-5-pyriMidinecarboxylate

C8H9ClN2O2S (232.00732440000002)


   

1,3-Dioxolane,4-(chloromethyl)-2-(4-chlorophenyl)-

1,3-Dioxolane,4-(chloromethyl)-2-(4-chlorophenyl)-

C10H10Cl2O2 (232.00578200000004)


   

dimethylmercury

dimethylmercury

C2H6Hg (232.0175796)


   

3-Fluoro-2-methyl-4-(methylsulfonyl)benzoic acid

3-Fluoro-2-methyl-4-(methylsulfonyl)benzoic acid

C9H9FO4S (232.0205566)


   

2h-1,2,4-benzothiadiazine, 3-(chloromethyl)-3,4-dihydro-, 1,1-dioxide (9ci)

2h-1,2,4-benzothiadiazine, 3-(chloromethyl)-3,4-dihydro-, 1,1-dioxide (9ci)

C8H9ClN2O2S (232.00732440000002)


   
   
   

BENZENEACETIC ACID, 3,5-DICHLORO-, ETHYL ESTER

BENZENEACETIC ACID, 3,5-DICHLORO-, ETHYL ESTER

C10H10Cl2O2 (232.00578200000004)


   

5-Nitro-2-(trifluoromethoxy)benzonitrile

5-Nitro-2-(trifluoromethoxy)benzonitrile

C8H3F3N2O3 (232.0095764)


   

N-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-2-chloroacetamide

N-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-2-chloroacetamide

C8H9ClN2O2S (232.00732440000002)


   

1,1,2,2-Tetrafluoroethyl-2,2,3,3-tetrafluoropropylether

1,1,2,2-Tetrafluoroethyl-2,2,3,3-tetrafluoropropylether

C5H4F8O (232.01343899999998)


   

4-Chloro-2-(4-morpholino)-5-thiazolecarboxaldehyde

4-Chloro-2-(4-morpholino)-5-thiazolecarboxaldehyde

C8H9ClN2O2S (232.00732440000002)


   
   

cyclobutane-1,1,3,3-tetracarboxylic acid

cyclobutane-1,1,3,3-tetracarboxylic acid

C8H8O8 (232.02191679999999)


   

1,2,3,4-CYCLOBUTANETETRACARBOXYLIC ACID

1,2,3,4-CYCLOBUTANETETRACARBOXYLIC ACID

C8H8O8 (232.02191679999999)


   

1,1,3,3,3-Pentafluoro-2-trifluoromethylpropyl methyl ether

1,1,3,3,3-Pentafluoro-2-trifluoromethylpropyl methyl ether

C5H4F8O (232.01343899999998)


   

4-NITRO-2-(TRIFLUOROMETHYL)BENZO[D]OXAZOLE

4-NITRO-2-(TRIFLUOROMETHYL)BENZO[D]OXAZOLE

C8H3F3N2O3 (232.0095764)


   

4-Formyl-2-methoxyphenyl hydrogen sulfate

4-Formyl-2-methoxyphenyl hydrogen sulfate

C8H8O6S (232.0041588)


   
   

2-Formyl-6-methoxyphenyl dihydrogen phosphate

2-Formyl-6-methoxyphenyl dihydrogen phosphate

C8H9O6P (232.01367439999999)


   

[(3R,4S)-5-fluoro-3,4-dihydroxy-2-oxopentyl] dihydrogen phosphate

[(3R,4S)-5-fluoro-3,4-dihydroxy-2-oxopentyl] dihydrogen phosphate

C5H10FO7P (232.0148172)


   

[(2R,3R,4S,5S)-5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl] dihydrogen phosphate

[(2R,3R,4S,5S)-5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl] dihydrogen phosphate

C5H10FO7P (232.0148172)


   

7-Hydroxy-3-(thiophen-2-yl)isobenzofuran-1(3H)-one

7-Hydroxy-3-(thiophen-2-yl)isobenzofuran-1(3H)-one

C12H8O3S (232.0194138)


   

Methyl-4-hydroxybenzoate sulfate

Methyl-4-hydroxybenzoate sulfate

C8H8O6S (232.0041588)


   

4-Hydroxyphenylacetic acid sulfate

4-Hydroxyphenylacetic acid sulfate

C8H8O6S (232.0041588)


   

2-[4-(sulfooxy)phenyl]acetic acid

2-[4-(sulfooxy)phenyl]acetic acid

C8H8O6S (232.0041588)


   

2-[3-(sulfooxy)phenyl]acetic acid

2-[3-(sulfooxy)phenyl]acetic acid

C8H8O6S (232.0041588)


   

2-O-sulfate-4-hydroxyacetophenone

2-O-sulfate-4-hydroxyacetophenone

C8H8O6S (232.0041588)


An acetophenone substituted by a sulfooxy group at position 2 and by a hydroxy group at position 4.

   

4-acetylcatechol sulfate

C8H8O6S (232.0041588)


new metabolite created