Exact Mass: 252.0454

Exact Mass Matches: 252.0454

Found 80 metabolites which its exact mass value is equals to given mass value 252.0454, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Morindaparvin A

1,2-Methylenedioxyanthraquinone

C15H8O4 (252.0423)


   

3,3-bipyridine-2,2,5,5,6,6-hexol

3,3-bipyridine-2,2,5,5,6,6-hexol

C10H8N2O6 (252.0382)


   

Tretazicar

Tretazicar

C9H8N4O5 (252.0495)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent COVID info from PDB, Protein Data Bank D011838 - Radiation-Sensitizing Agents D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   
   

Nigakinone

3,4-dihydroxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10,12,14-heptaen-2-one

C14H8N2O3 (252.0535)


Nigakinone is an alkaloid from the wood of Picrasma excelsa (Jamaican quassiawood

   

Monoisoamyl 2,3-dimercaptosuccinate

4-(3-methylbutoxy)-4-oxo-2,3-disulfanylbutanoic acid

C9H16O4S2 (252.049)


   

Monoisoamyl dimercaptosuccinic acid

2-(3-Methylbutyl)-2,3-disulphanylbutanedioic acid

C9H16O4S2 (252.049)


   

Tretazicar

5-(Aziridin-1-yl)-2,4-dinitrobenzene-1-carboximidate

C9H8N4O5 (252.0495)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent COVID info from PDB, Protein Data Bank D011838 - Radiation-Sensitizing Agents D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

4-(3-Methylbutoxy)-4-oxo-2,2-bis(sulfanyl)butanoic acid

4-(3-Methylbutoxy)-4-oxo-2,2-bis(sulphanyl)butanoic acid

C9H16O4S2 (252.049)


   

8-Chlorogoniodiol

8-Chlorogoniodiol

C13H13ClO3 (252.0553)


   

9,10-Dihydro-1-hydroxy-9,10-dioxo-2-anthracenecarboxaldehyde

9,10-Dihydro-1-hydroxy-9,10-dioxo-2-anthracenecarboxaldehyde

C15H8O4 (252.0423)


   

MLS000111874

MLS000111874

C13H8N4S (252.047)


   

1,1-OXYBIS(4-ISOCYANATOBENZENE)

1,1-OXYBIS(4-ISOCYANATOBENZENE)

C14H8N2O3 (252.0535)


   

Maybridge4_004209

Maybridge4_004209

C11H12N2OS2 (252.0391)


   

2-[2-(2-Cyano-3-fluoroanilino)-2-oxoethoxy]acetic acid

2-[2-(2-Cyano-3-fluoroanilino)-2-oxoethoxy]acetic acid

C11H9FN2O4 (252.0546)


   

4,6-Bis(2-furyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile

4,6-Bis(2-furyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile

C14H8N2O3 (252.0535)


   

2-(Morpholinothio)benzothiazole

2-(Morpholinothio)benzothiazole

C11H12N2OS2 (252.0391)


   

7-Hydroxy-6-methoxy-4-(methylthio)-5-methylcoumarin

7-Hydroxy-6-methoxy-4-(methylthio)-5-methylcoumarin

C12H12O4S (252.0456)


   

Acuminol A

Acuminol A

C15H8O4 (252.0423)


   

2,7-dihydroxy-5H-phenanthro[4,5-bcd]pyran-5-one|unifloranthrone

2,7-dihydroxy-5H-phenanthro[4,5-bcd]pyran-5-one|unifloranthrone

C15H8O4 (252.0423)


   

3-hydroxy-9,10-dioxo-anthracene-2-carbaldehyde

3-hydroxy-9,10-dioxo-anthracene-2-carbaldehyde

C15H8O4 (252.0423)


   

2-Formyl-1-hydroxyanthraquinone

2-Formyl-1-hydroxyanthraquinone

C15H8O4 (252.0423)


   

Anthraquinone-2-carboxylic acid

Anthraquinone-2-carboxylic acid

C15H8O4 (252.0423)


Anthraquinone-2-carboxylic acid is a major anthraquinone isolated from Brazilian taheebo, with anti-inflammatory activity and antinociceptive[1]. Anthraquinone-2-carboxylic acid is a major anthraquinone isolated from Brazilian taheebo, with anti-inflammatory activity and antinociceptive[1].

   

AQCA-9,10

2-Anthracenecarboxylic acid, 9,10-dihydro-9,10-dioxo-

C15H8O4 (252.0423)


Anthraquinone-2-carboxylic acid is a natural product found in Handroanthus impetiginosus with data available. Anthraquinone-2-carboxylic acid is a major anthraquinone isolated from Brazilian taheebo, with anti-inflammatory activity and antinociceptive[1]. Anthraquinone-2-carboxylic acid is a major anthraquinone isolated from Brazilian taheebo, with anti-inflammatory activity and antinociceptive[1].

   

2-Morpholinothiobenzothiazole

2-(Morpholinothio)benzothiazole

C11H12N2OS2 (252.0391)


CONFIDENCE standard compound; INTERNAL_ID 2878 CONFIDENCE standard compound; INTERNAL_ID 8842

   

BBT(OAc)2

4-(thiophen-2-yl)but-3-yne-1,2-diyl diacetate

C12H12O4S (252.0456)


   

2-amino-4-phenyl-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile

2-amino-4-phenyl-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile

C13H8N4S (252.047)


   

6-fluoro-2,3-dihydro-2H,5H-spiro[imidazolidine-4,4-thiochromene]-2,5-dione

6-fluoro-2,3-dihydro-2H,5H-spiro[imidazolidine-4,4-thiochromene]-2,5-dione

C11H9FN2O2S (252.0369)


   

iodomethylcyclooctane

iodomethylcyclooctane

C9H17I (252.0375)


   

5-Chloro-3-phenyl-1H-indole-2-carbonitrile

5-Chloro-3-phenyl-1H-indole-2-carbonitrile

C15H9ClN2 (252.0454)


   

ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanylmethylsulfanyl]acetate

ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanylmethylsulfanyl]acetate

C9H16O4S2 (252.049)


   

8-nitroquinoline-2-carboximidamide,hydrochloride

8-nitroquinoline-2-carboximidamide,hydrochloride

C10H9ClN4O2 (252.0414)


   

3-ALLYL-5,6-DIMETHYL-2-THIOXO-2,3-DIHYDROTHIENO[2,3-D]PYRIMIDIN-4(1H)-ONE

3-ALLYL-5,6-DIMETHYL-2-THIOXO-2,3-DIHYDROTHIENO[2,3-D]PYRIMIDIN-4(1H)-ONE

C11H12N2OS2 (252.0391)


   

Methyl 2-amino-5-(4-fluorophenyl)-1,3-thiazole-4-carboxylate

Methyl 2-amino-5-(4-fluorophenyl)-1,3-thiazole-4-carboxylate

C11H9FN2O2S (252.0369)


   

(S)-3-AMINO-4-(PYRIDIN-4-YL)BUTANOIC ACID DIHYDROCHLORIDE

(S)-3-AMINO-4-(PYRIDIN-4-YL)BUTANOIC ACID DIHYDROCHLORIDE

C9H14Cl2N2O2 (252.0432)


   

Methyl 3-pyridin-3-yl-D-alaninate dihydrochloride

Methyl 3-pyridin-3-yl-D-alaninate dihydrochloride

C9H14Cl2N2O2 (252.0432)


   

(4-((1H-Pyrazol-1-yl)sulfonyl)phenyl)boronic acid

(4-((1H-Pyrazol-1-yl)sulfonyl)phenyl)boronic acid

C9H9BN2O4S (252.0376)


   

Ethyl 4-fluoro-7-nitro-1H-indole-2-carboxylate

Ethyl 4-fluoro-7-nitro-1H-indole-2-carboxylate

C11H9FN2O4 (252.0546)


   

1-(4-Chlorophenyl)-4-oxocyclohexanecarboxylic acid

1-(4-Chlorophenyl)-4-oxocyclohexanecarboxylic acid

C13H13ClO3 (252.0553)


   

5-Amino-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-acetamide

5-Amino-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-acetamide

C10H9FN4OS (252.0481)


   

3-(2-Pyridyl)alanine

3-(2-Pyridyl)alanine

C9H14Cl2N2O2 (252.0432)


   

2,4-Dinitrophenylmethacrylate

2,4-Dinitrophenylmethacrylate

C10H8N2O6 (252.0382)


   

5-Amino-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-acetamide

5-Amino-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-acetamide

C10H9FN4OS (252.0481)


   

methyl 4-(1,1,2,2-tetrafluoroethoxy)benzoate

methyl 4-(1,1,2,2-tetrafluoroethoxy)benzoate

C10H8F4O3 (252.041)


   

1-Anthraquinonecarboxylic acid

1-Anthraquinonecarboxylic acid

C15H8O4 (252.0423)


   

3-(4-DIMETHYLAMINO-PHENYL)-2-THIOXO-THIAZOLIDIN-4-ONE

3-(4-DIMETHYLAMINO-PHENYL)-2-THIOXO-THIAZOLIDIN-4-ONE

C11H12N2OS2 (252.0391)


   

4-[alpha-(4-Cyanophenyl)-chloromethyl]-benzonitrile

4-[alpha-(4-Cyanophenyl)-chloromethyl]-benzonitrile

C15H9ClN2 (252.0454)


   

N-Succinimidyl maleimidoacetate

N-Succinimidyl maleimidoacetate

C10H8N2O6 (252.0382)


   

3-(6-NITRO-2-OXO-1,3-BENZOXAZOL-3(2H)-YL)PROPANOIC ACID

3-(6-NITRO-2-OXO-1,3-BENZOXAZOL-3(2H)-YL)PROPANOIC ACID

C10H8N2O6 (252.0382)


   

5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

C12H12O4S (252.0456)


   

Ethyl 2-Amino-2-(2-pyridinyl)acetate Dihydrochloride

Ethyl 2-Amino-2-(2-pyridinyl)acetate Dihydrochloride

C9H14Cl2N2O2 (252.0432)


   

methyl (Z)-5-chloro-3-hydroxy-2-methylidene-5-phenylpent-4-enoate

methyl (Z)-5-chloro-3-hydroxy-2-methylidene-5-phenylpent-4-enoate

C13H13ClO3 (252.0553)


   

4,4-oxybis(phenyl isocyanate)

4,4-oxybis(phenyl isocyanate)

C14H8N2O3 (252.0535)


   

(R)-3-AMINO-4-(PYRIDIN-4-YL)BUTANOIC ACID DIHYDROCHLORIDE

(R)-3-AMINO-4-(PYRIDIN-4-YL)BUTANOIC ACID DIHYDROCHLORIDE

C9H14Cl2N2O2 (252.0432)


   

(S)-3-AMINO-4-(PYRIDIN-3-YL)BUTANOIC ACID DIHYDROCHLORIDE

(S)-3-AMINO-4-(PYRIDIN-3-YL)BUTANOIC ACID DIHYDROCHLORIDE

C9H14Cl2N2O2 (252.0432)


   

Methyl 2-amino-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate

Methyl 2-amino-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate

C11H9FN2O2S (252.0369)


   

Methyl 2-amino-5-(2-fluorophenyl)-1,3-thiazole-4-carboxylate

Methyl 2-amino-5-(2-fluorophenyl)-1,3-thiazole-4-carboxylate

C11H9FN2O2S (252.0369)


   

Ethyl 2-Amino-2-(4-pyridinyl)acetate Dihydrochloride

Ethyl 2-Amino-2-(4-pyridinyl)acetate Dihydrochloride

C9H14Cl2N2O2 (252.0432)


   

6-(3-CHLOROPROPOXY)-4-METHYLCOUMARIN

6-(3-CHLOROPROPOXY)-4-METHYLCOUMARIN

C13H13ClO3 (252.0553)


   

1-(2-bromoprop-2-enyl)-4-tert-butylbenzene

1-(2-bromoprop-2-enyl)-4-tert-butylbenzene

C13H17Br (252.0514)


   

(S)-2-Amino-3-(3-aminophenyl)propanoic acid dihydrochloride

(S)-2-Amino-3-(3-aminophenyl)propanoic acid dihydrochloride

C9H14Cl2N2O2 (252.0432)


   

3-Bromopropoxy t-Butyl-Dimethylsilane

3-Bromopropoxy t-Butyl-Dimethylsilane

C9H21BrOSi (252.0545)


   

(R)-3-AMINO-4-(PYRIDIN-3-YL)BUTANOIC ACID DIHYDROCHLORIDE

(R)-3-AMINO-4-(PYRIDIN-3-YL)BUTANOIC ACID DIHYDROCHLORIDE

C9H14Cl2N2O2 (252.0432)


   

1-(2-Chlorophenyl)-4-oxocyclohexanecarboxylic acid

1-(2-Chlorophenyl)-4-oxocyclohexanecarboxylic acid

C13H13ClO3 (252.0553)


   

3-Oxo-2-phenyl-1,2-benzothiazole-6-carbonitrile

3-Oxo-2-phenyl-1,2-benzothiazole-6-carbonitrile

C14H8N2OS (252.0357)


   

3-Oxo-2-phenyl-1,2-benzothiazole-5-carbonitrile

3-Oxo-2-phenyl-1,2-benzothiazole-5-carbonitrile

C14H8N2OS (252.0357)


   

2-Cyclopropylimino-3-(thiophen-2-ylmethyl)-1,3-thiazolidin-4-one

2-Cyclopropylimino-3-(thiophen-2-ylmethyl)-1,3-thiazolidin-4-one

C11H12N2OS2 (252.0391)


   

6-(Carboxymethoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(Carboxymethoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C8H12O9 (252.0481)


   

1-(Butylstannyl)butan-2-ol

1-(Butylstannyl)butan-2-ol

C8H20OSn (252.0536)


   

(5E)-3-ethyl-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylideneimidazolidin-4-one

(5E)-3-ethyl-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylideneimidazolidin-4-one

C11H12N2OS2 (252.0391)


   

[4-(Hydroxyamino)-3-(4-nitrophenyl)-1,2-oxazol-5-yl]-oxidoazanium

[4-(Hydroxyamino)-3-(4-nitrophenyl)-1,2-oxazol-5-yl]-oxidoazanium

C9H8N4O5 (252.0495)


   

6-(2-chloro-1-hydroxy-2-phenylethyl)-5,6-dihydropyran-2-one

6-(2-chloro-1-hydroxy-2-phenylethyl)-5,6-dihydropyran-2-one

C13H13ClO3 (252.0553)


   

(6r)-6-[(1r,2r)-2-chloro-1-hydroxy-2-phenylethyl]-5,6-dihydropyran-2-one

(6r)-6-[(1r,2r)-2-chloro-1-hydroxy-2-phenylethyl]-5,6-dihydropyran-2-one

C13H13ClO3 (252.0553)


   

8-chlorogoniodiol

NA

C13H13ClO3 (252.0553)


{"Ingredient_id": "HBIN013688","Ingredient_name": "8-chlorogoniodiol","Alias": "NA","Ingredient_formula": "C13H13ClO3","Ingredient_Smile": "C1C=CC(=O)OC1C(C(C2=CC=CC=C2)Cl)O","Ingredient_weight": "252.69 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3555","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10988787","DrugBank_id": "NA"}

   

9-hydroxycanthin-6-one 3-n-oxide

NA

C14H8N2O3 (252.0535)


{"Ingredient_id": "HBIN014119","Ingredient_name": "9-hydroxycanthin-6-one 3-n-oxide","Alias": "NA","Ingredient_formula": "C14H8N2O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9886","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

1-hydroxy-9,10-dioxoanthracene-2-carbaldehyde

1-hydroxy-9,10-dioxoanthracene-2-carbaldehyde

C15H8O4 (252.0423)


   

(6r)-6-[(1s,2r)-2-chloro-1-hydroxy-2-phenylethyl]-5,6-dihydropyran-2-one

(6r)-6-[(1s,2r)-2-chloro-1-hydroxy-2-phenylethyl]-5,6-dihydropyran-2-one

C13H13ClO3 (252.0553)


   

11-hydroxyfuro[3,2-b]xanthen-5-one

11-hydroxyfuro[3,2-b]xanthen-5-one

C15H8O4 (252.0423)


   

7-hydroxy-6-methoxy-5-methyl-4-(methylsulfanyl)chromen-2-one

7-hydroxy-6-methoxy-5-methyl-4-(methylsulfanyl)chromen-2-one

C12H12O4S (252.0456)


   

3-hydroxy-9,10-dioxoanthracene-2-carbaldehyde

3-hydroxy-9,10-dioxoanthracene-2-carbaldehyde

C15H8O4 (252.0423)