Exact Mass: 217.9942366

Exact Mass Matches: 217.9942366

Found 92 metabolites which its exact mass value is equals to given mass value 217.9942366, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

5-Sulfosalicylic acid

Sulfosalicylic acid, beryllium salt (1:1)

C7H6O6S (217.98850960000001)


5-Sulfosalicylic acid is a derivative of salicylic acid, a common anti-inflammatory drug.Sulfosalicylic acid is used in urine tests to determine urine protein content. The chemical causes the precipitation of dissolved proteins, which is measured from the degree of turbidity. It is also used for integral colour anodizing. -Wikipedia [HMDB] 5-Sulfosalicylic acid is a derivative of salicylic acid, a common anti-inflammatory drug. Sulfosalicylic acid is used in urine tests to determine urine protein content. The chemical causes the precipitation of dissolved proteins, which is measured from the degree of turbidity. It is also used for integral colour anodizing. -Wikipedia. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

3-hydroxybenzoic acid-3-O-sulphate

3-Hydroxybenzoic acid-3-O-sulphuric acid

C7H6O6S (217.98850960000001)


3-hydroxybenzoic acid-3-O-sulphate is a conjugate of 3-hydroxybenzoic acid and sulphate. 3-Hydroxybenzoic acid is a monohydroxybenzoic acid. 3-Hydroxybenzoic acid can be formed by a Pseudomonas species from 3-chlorobenzoic acid. (Wikipedia)

   

4-hydroxybenzoic acid-4-O-sulphate

4-Hydroxybenzoic acid-4-O-sulphuric acid

C7H6O6S (217.98850960000001)


4-hydroxybenzoic acid-4-O-sulphate is a conjugate of 4-hydroxybenzoic acid and sulphate. 4-phenylbutyric acid is a monocarboxylic acid the structure of which is that of butyric acid substituted with a phenyl group at C-4. It is a histone deacetylase inhibitor that displays anticancer activity. It inhibits cell proliferation, invasion and migration and induces apoptosis in glioma cells. It also inhibits protein isoprenylation, depletes plasma glutamine, increases production of foetal haemoglobin through transcriptional activation of the γ-globin gene and affects hPPARγ activation. (CHEBI:41500) 4-hydroxybenzoic acid 4-o-sulphate, also known as 4-sulfooxybenzoic acid, is a member of the class of compounds known as phenylsulfates. Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. 4-hydroxybenzoic acid 4-o-sulphate is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 4-hydroxybenzoic acid 4-o-sulphate can be found primarily in urine.

   

4-Methylcatechol sulfate

6,7-dihydroxy-9-methyl-2,4-dioxa-3lambda6-thiabicyclo[3.3.1]nona-1(9),5,7-triene-3,3-dione

C7H6O6S (217.98850960000001)


   

Pyromellitic dianhydride

5,11-dioxatricyclo[7.3.0.0³,⁷]dodeca-1,3(7),8-triene-4,6,10,12-tetrone

C10H2O6 (217.9851392)


   

butane-1,4-disulfonic acid

Butane-1,4-disulphonic acid

C4H10O6S2 (217.99188)


   

Ethylene dimethanesulfonate

2-(methanesulfonyloxy)ethyl methanesulfonate

C4H10O6S2 (217.99188)


   

Fosfosal

2-Carboxyphenylphosphoric acid

C7H7O6P (217.9980252)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

N-Demethoxylinuron

1-(3,4-DICHLOROPHENYL)-1H-PYRAZOL-3-AMINE

C8H8Cl2N2O (218.00136579999997)


   

1-(3,4-Dichlorophenyl)-3-methylurea

1-(3,4-DICHLOROPHENYL)-1H-PYRAZOL-3-AMINE

C8H8Cl2N2O (218.00136579999997)


CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4070; ORIGINAL_PRECURSOR_SCAN_NO 4067 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4107; ORIGINAL_PRECURSOR_SCAN_NO 4104 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4080; ORIGINAL_PRECURSOR_SCAN_NO 4078 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4066; ORIGINAL_PRECURSOR_SCAN_NO 4064 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8694; ORIGINAL_PRECURSOR_SCAN_NO 8693 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8700; ORIGINAL_PRECURSOR_SCAN_NO 8699 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8691; ORIGINAL_PRECURSOR_SCAN_NO 8688 CONFIDENCE standard compound; INTERNAL_ID 187; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8713; ORIGINAL_PRECURSOR_SCAN_NO 8709

   

Aldehyde-5-(2-Thienylethynyl)-2-thiophenemthanol

Aldehyde-5-(2-Thienylethynyl)-2-thiophenemthanol

C11H6OS2 (217.9860066)


   

fosfosal

fosfosal

C7H7O6P (217.9980252)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

Diuron-desmonomethyl

1-(3,4-DICHLOROPHENYL)-1H-PYRAZOL-3-AMINE

C8H8Cl2N2O (218.00136579999997)


CONFIDENCE standard compound; INTERNAL_ID 4001

   

Diuron-desmethyl

1-(3,4-DICHLOROPHENYL)-1H-PYRAZOL-3-AMINE

C8H8Cl2N2O (218.00136579999997)


A member of the class of phenylureas that is urea in which a hydrogens attached to one nitrogen is substituted by a methyl group, and one of the hydrogens attached to the other nitrogen is substituted by a 3,4-dichlorophenyl group. It is a metabolite of diuron. CONFIDENCE standard compound; EAWAG_UCHEM_ID 294

   

3-Hydroxybenzoic acid sulfate

3-Hydroxybenzoic acid sulfate

C7H6O6S (217.98850960000001)


   

2-Hydroxybenzoic acid sulfate

2-Hydroxybenzoic acid sulfate

C7H6O6S (217.98850960000001)


   

4-Hydroxybenzoic acid sulfate

4-Hydroxybenzoic acid sulfate

C7H6O6S (217.98850960000001)


   

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE10

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE10

C7H6O6S (217.98850960000001)


   

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE20

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE20

C7H6O6S (217.98850960000001)


   

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE30

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE30

C7H6O6S (217.98850960000001)


   

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE40

2-Hydroxy-5-sulfobenzoic acid; LC-tDDA; CE40

C7H6O6S (217.98850960000001)


   

5-Sulfosalicylic acid

5-Sulfosalicylic acid

C7H6O6S (217.98850960000001)


An arenesulfonic acid that is benzoic acid substituted by a hydroxy at position C-2 and a sulfo group at C-5.

   

2-(2,4-DICHLORO-PHENYL)-N-HYDROXY-ACETAMIDINE

2-(2,4-DICHLORO-PHENYL)-N-HYDROXY-ACETAMIDINE

C8H8Cl2N2O (218.00136579999997)


   

ethyl 2,6-dichlorobenzoate

ethyl 2,6-dichlorobenzoate

C9H8Cl2O2 (217.9901328)


   

Benzaldehyde, 3,5-dichloro-2-ethoxy- (9CI)

Benzaldehyde, 3,5-dichloro-2-ethoxy- (9CI)

C9H8Cl2O2 (217.9901328)


   

3-(2,6-DICHLOROPHENYL)PROPIONIC ACID

3-(2,6-DICHLOROPHENYL)PROPIONIC ACID

C9H8Cl2O2 (217.9901328)


   

3-(2,3-Dichlorophenyl)propionic acid

3-(2,3-Dichlorophenyl)propionic acid

C9H8Cl2O2 (217.9901328)


   

3-(2,4-Dichlorophenyl)propanoic acid

3-(2,4-Dichlorophenyl)propanoic acid

C9H8Cl2O2 (217.9901328)


   

1-(3,5-Dichlorophenoxy)propan-2-one

1-(3,5-Dichlorophenoxy)propan-2-one

C9H8Cl2O2 (217.9901328)


   

3-(3,5-Dichlorophenyl)propanoic acid

3-(3,5-Dichlorophenyl)propanoic acid

C9H8Cl2O2 (217.9901328)


   

5,6,7,8-TETRAFLUOROCOUMARIN

5,6,7,8-TETRAFLUOROCOUMARIN

C9H2F4O2 (217.999092)


   

3-BROMO-4-FLUORO-BENZYL-HYDRAZINE

3-BROMO-4-FLUORO-BENZYL-HYDRAZINE

C7H8BrFN2 (217.98548399999999)


   

2-Nitroaniline-4-Sulfonic Acid

2-Nitroaniline-4-Sulfonic Acid

C6H6N2O5S (217.9997426)


   

2,3,5,6-tetrafluorobenzotrifluoride

2,3,5,6-tetrafluorobenzotrifluoride

C7HF7 (217.996647)


   

4-NITRO-2-AMINOBENZENESULFONIC ACID

4-NITRO-2-AMINOBENZENESULFONIC ACID

C6H6N2O5S (217.9997426)


   

2-(3,4-dichloro-phenyl)-n-hydroxy-acetamidine

2-(3,4-dichloro-phenyl)-n-hydroxy-acetamidine

C8H8Cl2N2O (218.00136579999997)


   
   

2-Amino-5-nitrobenzenesulfonic acid

2-Amino-5-nitrobenzenesulfonic acid

C6H6N2O5S (217.9997426)


   

ETHYL 3,5-DICHLOROBENZOATE

ETHYL 3,5-DICHLOROBENZOATE

C9H8Cl2O2 (217.9901328)


   

Methyl chloro(2-chlorophenyl)acetate

Methyl chloro(2-chlorophenyl)acetate

C9H8Cl2O2 (217.9901328)


   

2-(2,6-dichloro-phenyl)-n-hydroxy-acetamidine

2-(2,6-dichloro-phenyl)-n-hydroxy-acetamidine

C8H8Cl2N2O (218.00136579999997)


   

Methyl (2,4-dichlorophenyl)acetate

Methyl (2,4-dichlorophenyl)acetate

C9H8Cl2O2 (217.9901328)


   

Methyl (3,4-dichlorophenyl)acetate

Methyl (3,4-dichlorophenyl)acetate

C9H8Cl2O2 (217.9901328)


   

Ethyl 2-chloro-4,4,4-trifluoroacetoacetate

Ethyl 2-chloro-4,4,4-trifluoroacetoacetate

C6H6ClF3O3 (217.9957552)


   

Trichloro(2,3-dimethyl-2-butanyl)silane

Trichloro(2,3-dimethyl-2-butanyl)silane

C6H13Cl3Si (217.98520680000001)


   

1,2,3,5-tetrafluoro-4-trifluoromethyl-benzene

1,2,3,5-tetrafluoro-4-trifluoromethyl-benzene

C7HF7 (217.996647)


   

Salicylsulfuric acid

2-(SULFOOXY)BENZOIC ACID

C7H6O6S (217.98850960000001)


   

3-chloro-1-(4-chloro-2-hydroxyphenyl)propan-1-one

3-chloro-1-(4-chloro-2-hydroxyphenyl)propan-1-one

C9H8Cl2O2 (217.9901328)


   

6-chloro-8-(chloromethyl)-4H-1,3-benzodioxine

6-chloro-8-(chloromethyl)-4H-1,3-benzodioxine

C9H8Cl2O2 (217.9901328)


   

N-(2-AMINO-4 5-DICHLOROPHENYL)ACETAMIDE&

N-(2-AMINO-4 5-DICHLOROPHENYL)ACETAMIDE&

C8H8Cl2N2O (218.00136579999997)


   

5-Borono-4-chloro-2-fluorobenzoic acid

5-Borono-4-chloro-2-fluorobenzoic acid

C7H5BClFO4 (217.9953442)


   

Benzenesulfonic acid,4-amino-2-nitro-

Benzenesulfonic acid,4-amino-2-nitro-

C6H6N2O5S (217.9997426)


   

1-(5-CHLORO-3-CHLOROMETHYL-2-HYDROXY-PHENYL)-ETHANONE

1-(5-CHLORO-3-CHLOROMETHYL-2-HYDROXY-PHENYL)-ETHANONE

C9H8Cl2O2 (217.9901328)


   

1-Bromo-5-dioxolanecyclohex-1-ene

1-Bromo-5-dioxolanecyclohex-1-ene

C8H11BrO2 (217.9942366)


   

Ethyl 2,5-dichlorobenzoate

Ethyl 2,5-dichlorobenzoate

C9H8Cl2O2 (217.9901328)


   

N-(4-amino-2,6-dichloro-phenyl)acetamide

N-(4-amino-2,6-dichloro-phenyl)acetamide

C8H8Cl2N2O (218.00136579999997)


   

4-fluorobenzenesulfinic acid sodium salt

4-fluorobenzenesulfinic acid sodium salt

C6H8FNaO4S (218.002502)


   

4-氯-2-甲硫基-5-甲酸乙酯嘧啶

4-氯-2-甲硫基-5-甲酸乙酯嘧啶

C7H7ClN2O2S (217.9916752)


   

2-(2,6-Dichlorophenyl)acetohydrazide

2-(2,6-Dichlorophenyl)acetohydrazide

C8H8Cl2N2O (218.00136579999997)


   
   

Ethanone, 2-chloro-1-(3-chloro-4-methoxyphenyl)- (9CI)

Ethanone, 2-chloro-1-(3-chloro-4-methoxyphenyl)- (9CI)

C9H8Cl2O2 (217.9901328)


   

Bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyldichloride, (1R,2R,3R,4S)-rel-

Bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyldichloride, (1R,2R,3R,4S)-rel-

C9H8Cl2O2 (217.9901328)


   

7-CHLORO-3,4-DIHYDRO-2H-BENZO[E][1,2,4]THIADIAZINE 1,1-DIOXIDE

7-CHLORO-3,4-DIHYDRO-2H-BENZO[E][1,2,4]THIADIAZINE 1,1-DIOXIDE

C7H7ClN2O2S (217.9916752)


   

2-Bromo-5,5-dimethyl-cyclohexane-1,3-dione

2-Bromo-5,5-dimethyl-cyclohexane-1,3-dione

C8H11BrO2 (217.9942366)


   

1-(3,5-dichloro-2-hydroxyphenyl)propan-1-one

1-(3,5-dichloro-2-hydroxyphenyl)propan-1-one

C9H8Cl2O2 (217.9901328)


   

4,4-Difluorocyclohexanesulfonyl chloride

4,4-Difluorocyclohexanesulfonyl chloride

C6H9ClF2O2S (217.99798280000002)


   

2,5-dichloro-4,6-dimethylpyridine-3-carboxamide

2,5-dichloro-4,6-dimethylpyridine-3-carboxamide

C8H8Cl2N2O (218.00136579999997)


   

Potassium 4-(methoxycarbonyl)benzoate

Potassium 4-(methoxycarbonyl)benzoate

C9H7KO4 (217.9981402)


   

1,1,2,3,3,3-Hexafluoropropyl difluoromethyl ether

1,1,2,3,3,3-Hexafluoropropyl difluoromethyl ether

C4H2F8O (217.99778979999996)


   

3-BROMO-4-TRIMETHYLSILANYL-1H-PYRAZOLE

3-BROMO-4-TRIMETHYLSILANYL-1H-PYRAZOLE

C6H11BrN2Si (217.98748259999996)


   

3-(3,4-Dichlorophenyl)propanoic acid

3-(3,4-Dichlorophenyl)propanoic acid

C9H8Cl2O2 (217.9901328)


   

α,α,α,2,3,4,5-Heptafluorotoluene

α,α,α,2,3,4,5-Heptafluorotoluene

C7HF7 (217.996647)


   

ditungsten nitride

ditungsten nitride

H6N2W (218.0040486)


   

2-[(3,4-dichlorophenoxy)methyl]oxirane

2-[(3,4-dichlorophenoxy)methyl]oxirane

C9H8Cl2O2 (217.9901328)


   

1,1,1,3,3,4,4,4-OCTAFLUORO-2-BUTANOL

1,1,1,3,3,4,4,4-OCTAFLUORO-2-BUTANOL

C4H2F8O (217.99778979999996)


   

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

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

C7H7ClN2O2S (217.9916752)


   

2-(3,4-dichlorophenyl)acetohydrazide

2-(3,4-dichlorophenyl)acetohydrazide

C8H8Cl2N2O (218.00136579999997)


   

(4-chlorophenyl) 3-chloropropanoate

(4-chlorophenyl) 3-chloropropanoate

C9H8Cl2O2 (217.9901328)


   
   

1H-imidazole,trifluoromethanesulfonic acid

1H-imidazole,trifluoromethanesulfonic acid

C4H5F3N2O3S (217.9972976)


   

2-[(2,6-dichlorophenoxy)methyl]oxirane

2-[(2,6-dichlorophenoxy)methyl]oxirane

C9H8Cl2O2 (217.9901328)


   

ethyl 2,4-dichlorobenzoate

ethyl 2,4-dichlorobenzoate

C9H8Cl2O2 (217.9901328)


   

Methyl 2,3-Dichlorophenylacetate

Methyl 2,3-Dichlorophenylacetate

C9H8Cl2O2 (217.9901328)


   

(E)-3-(2-chloro-3,6-difluorophenyl)prop-2-enoic acid

(E)-3-(2-chloro-3,6-difluorophenyl)prop-2-enoic acid

C9H5ClF2O2 (217.99461240000002)


   

5-Chloro-2-(ethylthio)pyrimidine-4-carboxylic acid

5-Chloro-2-(ethylthio)pyrimidine-4-carboxylic acid

C7H7ClN2O2S (217.9916752)


   

Ethyl 3,4-Dichloro Benzoate

Ethyl 3,4-Dichloro Benzoate

C9H8Cl2O2 (217.9901328)


   

2-(2,3-DICHLOROPHENYL)PROPIONIC ACID

2-(2,3-DICHLOROPHENYL)PROPIONIC ACID

C9H8Cl2O2 (217.9901328)


   

3-hydroxybenzoic acid-3-O-sulphate

3-Hydroxybenzoic acid-3-O-sulphuric acid

C7H6O6S (217.98850960000001)


3-hydroxybenzoic acid-3-O-sulphate is a conjugate of 3-hydroxybenzoic acid and sulphate. 3-Hydroxybenzoic acid is a monohydroxybenzoic acid. 3-Hydroxybenzoic acid can be formed by a Pseudomonas species from 3-chlorobenzoic acid. (Wikipedia)

   

4-hydroxybenzoic acid-4-O-sulphate

4-Hydroxybenzoic acid-4-O-sulphuric acid

C7H6O6S (217.98850960000001)


4-hydroxybenzoic acid-4-O-sulphate is a conjugate of 4-hydroxybenzoic acid and sulphate. 4-phenylbutyric acid is a monocarboxylic acid the structure of which is that of butyric acid substituted with a phenyl group at C-4. It is a histone deacetylase inhibitor that displays anticancer activity. It inhibits cell proliferation, invasion and migration and induces apoptosis in glioma cells. It also inhibits protein isoprenylation, depletes plasma glutamine, increases production of foetal haemoglobin through transcriptional activation of the γ-globin gene and affects hPPARγ activation. (CHEBI:41500)

   

Sulfosalicylic Acid

2-Hydroxy-5-sulfobenzoic acid

C7H6O6S (217.98850960000001)


D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   
   

3-hydroxybenzoic acid-3-O-sulphate

3-hydroxybenzoic acid-3-O-sulphate

C7H6O6S (217.98850960000001)