Exact Mass: 283.0644682

Exact Mass Matches: 283.0644682

Found 106 metabolites which its exact mass value is equals to given mass value 283.0644682, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Penconazole

1-(2,4-dichloro-beta-Propylphenethyl)-1H-1,2,4-triazole

C13H15Cl2N3 (283.064297)


CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9666; ORIGINAL_PRECURSOR_SCAN_NO 9664 CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9722; ORIGINAL_PRECURSOR_SCAN_NO 9721 CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9751; ORIGINAL_PRECURSOR_SCAN_NO 9750 CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9670; ORIGINAL_PRECURSOR_SCAN_NO 9668 CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9676; ORIGINAL_PRECURSOR_SCAN_NO 9675 CONFIDENCE standard compound; INTERNAL_ID 411; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9793; ORIGINAL_PRECURSOR_SCAN_NO 9792 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3107 D016573 - Agrochemicals D010575 - Pesticides

   

Deoxythioguanosine

9-[5-(Hydroxymethyl)-3-sulphanyloxolan-2-yl]-2-imino-3,9-dihydro-2H-purin-6-ol

C10H13N5O3S (283.07390680000003)


   

N-(3,4-dihydroxybenzoyl)-glutamic acid

N-(3,4-dihydroxybenzoyl)-glutamic acid

C12H13NO7 (283.0691988)


   

2-Amino-4-(4-methoxyphenyl)-1-methyl-1H-imidazole-5-sulfonic acid

2-Amino-4-(4-methoxyphenyl)-1-methyl-1H-imidazole-5-sulfonic acid

C11H13N3O4S (283.0626738)


   
   
   

Penconazole

Pesticide6_Penconazole_C13H15Cl2N3_1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)pentyl]-

C13H15Cl2N3 (283.064297)


D016573 - Agrochemicals D010575 - Pesticides

   

5-Chloro-N-(1H-indol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-Chloro-N-(1H-indol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C14H10ClN5 (283.062469)


   

8-METHYL-2-(5-METHYLTHIEN-2-YL)QUINOLINE-4-CARBOXYLIC ACID

8-METHYL-2-(5-METHYLTHIEN-2-YL)QUINOLINE-4-CARBOXYLIC ACID

C16H13NO2S (283.06669580000005)


   
   
   

6-Thio-2-Deoxyguanosine

6-Thio-2-Deoxyguanosine

C10H13N5O3S (283.07390680000003)


6-Thio-2'-Deoxyguanosine is a nucleoside analogue that can be incorporated into de novo-synthesized telomeres by telomerase.

   

2-[(2,2-diethoxyethyl)thio]-1,3-benzothiazole

2-[(2,2-diethoxyethyl)thio]-1,3-benzothiazole

C13H17NO2S2 (283.07006620000004)


   
   
   

3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-1H-1,2,4-triazole-5-thione

3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-1H-1,2,4-triazole-5-thione

C12H14ClN3OS (283.0546064)


   

N-2-FLUOROPHENYL-3-(TRIFLUOROMETHYL)BENZAMIDE

N-2-FLUOROPHENYL-3-(TRIFLUOROMETHYL)BENZAMIDE

C14H9F4NO (283.0620232)


   

1,4-Diamino-5-nitro anthraquinone

1,4-Diamino-5-nitro anthraquinone

C14H9N3O4 (283.0593034)


   

2-[4-(4-BROMO-PHENYL)-PIPERAZIN-1-YL]-ETHYLAMINE

2-[4-(4-BROMO-PHENYL)-PIPERAZIN-1-YL]-ETHYLAMINE

C12H18BrN3 (283.0684008)


   

1-[2-(2-bromophenoxy)ethyl]-piperidine

1-[2-(2-bromophenoxy)ethyl]-piperidine

C13H18BrNO (283.0571678)


   

4-BROMO-N,N-DIISOPROPYLBENZAMIDE

4-BROMO-N,N-DIISOPROPYLBENZAMIDE

C13H18BrNO (283.0571678)


   

4-(3-(3-Bromophenyl)propyl)morpholine

4-(3-(3-Bromophenyl)propyl)morpholine

C13H18BrNO (283.0571678)


   

N-(5-BROMO-2-METHOXYBENZYL)CYCLOPENTANAMINE

N-(5-BROMO-2-METHOXYBENZYL)CYCLOPENTANAMINE

C13H18BrNO (283.0571678)


   

(r)-3-amino-4-(3-trifluoromethylphenyl)butanoic acid hydrochloride

(r)-3-amino-4-(3-trifluoromethylphenyl)butanoic acid hydrochloride

C11H13ClF3NO2 (283.0586864)


   

1-(CHLOROACETYL)-4-(4-NITROPHENYL)PIPERAZINE

1-(CHLOROACETYL)-4-(4-NITROPHENYL)PIPERAZINE

C12H14ClN3O3 (283.07236439999997)


   
   

1-[1-(4-Bromophenyl)ethyl]-4-piperidinol

1-[1-(4-Bromophenyl)ethyl]-4-piperidinol

C13H18BrNO (283.0571678)


   

(S)-3-AMINO-4-(3-(TRIFLUOROMETHYL)PHENYL)BUTANOIC ACID HYDROCHLORIDE

(S)-3-AMINO-4-(3-(TRIFLUOROMETHYL)PHENYL)BUTANOIC ACID HYDROCHLORIDE

C11H13ClF3NO2 (283.0586864)


   

2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID

2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID

C14H9N3O4 (283.0593034)


   

2-(2-NITRO-PHENYL)-1H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID

2-(2-NITRO-PHENYL)-1H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID

C14H9N3O4 (283.0593034)


   

2-(4-nitrophenyl)-1H-benzimidazole-4-carboxylic acid

2-(4-nitrophenyl)-1H-benzimidazole-4-carboxylic acid

C14H9N3O4 (283.0593034)


   

3-[(4-chloro-3-methylphenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione

3-[(4-chloro-3-methylphenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione

C12H14ClN3OS (283.0546064)


   

1-Boc-4-Chlorosulfonylpiperidine

1-Boc-4-Chlorosulfonylpiperidine

C10H18ClNO4S (283.0645018)


   

2-CHLORO-8-ETHYL-5,6,7,8-TETRAHYDRO-5-OXO-PYRIDO(2,3-D)PYRIMIDINE-6-CARBOXYLIC ACID ETHYL ESTER

2-CHLORO-8-ETHYL-5,6,7,8-TETRAHYDRO-5-OXO-PYRIDO(2,3-D)PYRIMIDINE-6-CARBOXYLIC ACID ETHYL ESTER

C12H14ClN3O3 (283.07236439999997)


   

2-(1,3-benzodioxol-5-yl)-6-nitroimidazo[1,2-a]pyridine

2-(1,3-benzodioxol-5-yl)-6-nitroimidazo[1,2-a]pyridine

C14H9N3O4 (283.0593034)


   

5-TERT-BUTYL-2-(3,4-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

5-TERT-BUTYL-2-(3,4-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

C13H15Cl2N3 (283.064297)


   

6-HYDROXY-2-(3-NITROPHENYL)QUINAZOLIN-4(3H)-ONE

6-HYDROXY-2-(3-NITROPHENYL)QUINAZOLIN-4(3H)-ONE

C14H9N3O4 (283.0593034)


   

1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]ethanone

1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]ethanone

C12H14ClN3O3 (283.07236439999997)


   

N-[4-(TRIFLUOROMETHYL)PHENYL]-2-FLUOROBENZAMIDE

N-[4-(TRIFLUOROMETHYL)PHENYL]-2-FLUOROBENZAMIDE

C14H9F4NO (283.0620232)


   

4-[2-PIPERIDINO-ETHOXY]PHENYLBROMIDE

4-[2-PIPERIDINO-ETHOXY]PHENYLBROMIDE

C13H18BrNO (283.0571678)


   

3-Bromo-N,N-diisopropylbenzamide

3-Bromo-N,N-diisopropylbenzamide

C13H18BrNO (283.0571678)


   

2-Bromo-N,N-diisopropylbenzamide

2-Bromo-N,N-diisopropylbenzamide

C13H18BrNO (283.0571678)


   

2-fluoro-1-methylpyridinium p-toluenesulfonate

2-fluoro-1-methylpyridinium p-toluenesulfonate

C13H14FNO3S (283.0678386)


   

(2-ISOPROPYL-PHENOXY)-ACETICACID

(2-ISOPROPYL-PHENOXY)-ACETICACID

C12H13NO7 (283.0691988)


   

CIS-1-OXO-SPIRO[CYCLOHEXANE-1,3(1H)-FURO[3,4-C]PYRIDINE]-4-CARBOXYLICACIDHYDROCHLORIDE

CIS-1-OXO-SPIRO[CYCLOHEXANE-1,3(1H)-FURO[3,4-C]PYRIDINE]-4-CARBOXYLICACIDHYDROCHLORIDE

C13H14ClNO4 (283.0611314)


   

2-[(E)-2-(4-Hydrazinophenyl)vinyl]pyridine dihydrochloride

2-[(E)-2-(4-Hydrazinophenyl)vinyl]pyridine dihydrochloride

C13H15Cl2N3 (283.064297)


   
   

6-methyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

6-methyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

C16H13NO2S (283.06669580000005)


   

Dexpramipexole (dihydrochloride)

Dexpramipexole (dihydrochloride)

C10H19Cl2N3S (283.0676674)


Dexpramipexole dihydrochloride ((R)-Pramipexole dihydrochloride) is a neuroprotective agent and weak non-ergoline dopamine agonist.

   

(R)-3-AMINO-4-(4-(TRIFLUOROMETHYL)PHENYL)BUTANOIC ACID HYDROCHLORIDE

(R)-3-AMINO-4-(4-(TRIFLUOROMETHYL)PHENYL)BUTANOIC ACID HYDROCHLORIDE

C11H13ClF3NO2 (283.0586864)


   
   

(s)-3-amino-4-(2-trifluoromethylphenyl)butanoic acid hydrochloride

(s)-3-amino-4-(2-trifluoromethylphenyl)butanoic acid hydrochloride

C11H13ClF3NO2 (283.0586864)


   

5-TERT-BUTYL-2-(2,6-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

5-TERT-BUTYL-2-(2,6-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

C13H15Cl2N3 (283.064297)


   

5-TERT-BUTYL-2-(2,5-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

5-TERT-BUTYL-2-(2,5-DICHLORO-PHENYL)-2H-PYRAZOL-3-YLAMINE

C13H15Cl2N3 (283.064297)


   

Pramipexole dihydrochloride

Pramipexole dihydrochloride

C10H19Cl2N3S (283.0676674)


D002491 - Central Nervous System Agents > D018726 - Anti-Dyskinesia Agents > D000978 - Antiparkinson Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018491 - Dopamine Agonists D020011 - Protective Agents > D000975 - Antioxidants Pramipexole dihydrochloride is a selective and blood-brain barrier (BBB) penetrant dopamine D2-type receptor agonist, with Kis of 2.2 nM, 3.9 nM, 0.5 nM and 1.3 nM for D2-type receptor, D2, D3 and D4 receptors, respectively. Pramipexole dihydrochloride can be used for the research of Parkinson's disease (PD) and restless legs syndrome (RLS)[1][2][3].

   

2-(d-gluco-pentylhydroxypentyl)-4(r)-1,3-thiazolidine-4-carboxylic acid

2-(d-gluco-pentylhydroxypentyl)-4(r)-1,3-thiazolidine-4-carboxylic acid

C9H17NO7S (283.07256920000003)


   

(s)-3-amino-4-(4-trifluoromethylphenyl)butanoic acid hydrochloride

(s)-3-amino-4-(4-trifluoromethylphenyl)butanoic acid hydrochloride

C11H13ClF3NO2 (283.0586864)


   

4-[3-(4-Bromophenyl)propyl]morpholine

4-[3-(4-Bromophenyl)propyl]morpholine

C13H18BrNO (283.0571678)


   
   

(R)-Methyl 3-aMino-4-(2,4,5-trifluorophenyl)butanoate hydrochloride

(R)-Methyl 3-aMino-4-(2,4,5-trifluorophenyl)butanoate hydrochloride

C11H13ClF3NO2 (283.0586864)


   

(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)(phenyl)acetic acid

(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)(phenyl)acetic acid

C14H9N3O4 (283.0593034)


   

Methyl 3-(2-ethoxy-2-oxoethoxy)-4-nitrobenzoate

Methyl 3-(2-ethoxy-2-oxoethoxy)-4-nitrobenzoate

C12H13NO7 (283.0691988)


   

2-(4-Trifluoromethylphenoxy)pyridine-5-boronic acid

2-(4-Trifluoromethylphenoxy)pyridine-5-boronic acid

C12H9BF3NO3 (283.062755)


   

N-Desaminosulfonyl-N-cyano Famotidine

N-Desaminosulfonyl-N-cyano Famotidine

C9H13N7S2 (283.0673818)


   

1-[3-(4-Bromophenoxy)propyl]pyrrolidine

1-[3-(4-Bromophenoxy)propyl]pyrrolidine

C13H18BrNO (283.0571678)


   

1-(3-BROMO-5-METHYLPYRIDIN-2-YL)-4-ETHYLPIPERAZINE

1-(3-BROMO-5-METHYLPYRIDIN-2-YL)-4-ETHYLPIPERAZINE

C12H18BrN3 (283.0684008)


   

6-Benzyl-4-chloro-4,5,6,7-tetrahydro-3H-pyrrolo[3,4-d]pyrimidine hydrochloride

6-Benzyl-4-chloro-4,5,6,7-tetrahydro-3H-pyrrolo[3,4-d]pyrimidine hydrochloride

C13H15Cl2N3 (283.064297)


   

n-4-fluorophenyl-3-(trifluoromethyl)benzamide

n-4-fluorophenyl-3-(trifluoromethyl)benzamide

C14H9F4NO (283.0620232)


   

(r)-3-amino-4-(2-trifluoromethylphenyl)butanoic acid hydrochloride

(r)-3-amino-4-(2-trifluoromethylphenyl)butanoic acid hydrochloride

C11H13ClF3NO2 (283.0586864)


   

N-(N-P-Nitro-Benzyloxycarbonyl)-Formimidoyl-2-Aminoethylthiol

N-(N-P-Nitro-Benzyloxycarbonyl)-Formimidoyl-2-Aminoethylthiol

C11H13N3O4S (283.0626738)


   

3-(4-nitrophenyl)-2H-phthalazine-1,4-dione

3-(4-nitrophenyl)-2H-phthalazine-1,4-dione

C14H9N3O4 (283.0593034)


   

4-[4-(Trifluoromethyl)phenyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine

4-[4-(Trifluoromethyl)phenyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine

C14H12F3NS (283.06425079999997)


   

4-(4-Fluorobenzoyl)-3-phenyl-1,2-oxazol-5(4H)-one

4-(4-Fluorobenzoyl)-3-phenyl-1,2-oxazol-5(4H)-one

C16H10FNO3 (283.0644682)


   
   
   

biochanin A(1-)

biochanin A(1-)

C16H11O5- (283.0606456)


Conjugate base of biochanin A arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3.

   

5-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-olate

5-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-olate

C16H11O5- (283.0606456)


Conjugate base of 5,7-dihydroxy-4-methoxyflavone.

   

2-amino-9-[5-(hydroxymethyl)-3-sulfanyloxolan-2-yl]-1H-purin-6-one

2-amino-9-[5-(hydroxymethyl)-3-sulfanyloxolan-2-yl]-1H-purin-6-one

C10H13N5O3S (283.07390680000003)


   

2-Hydroxy-1-methyl-3-phenylsulfanylquinolin-4-one

2-Hydroxy-1-methyl-3-phenylsulfanylquinolin-4-one

C16H13NO2S (283.06669580000005)


   

Calycosin(1-)

Calycosin(1-)

C16H11O5- (283.0606456)


A flavonoid oxoanion obtained by deprotonation of the hydroxy group at position 7 of calycosin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).

   

Wogonin(1-)

Wogonin(1-)

C16H11O5- (283.0606456)


The flavonoid oxoanion formed by deprotonation of the 7-hydroxy function of wogonin. Major structure at pH 7.3.

   
   

2-[1-(2-Hydroxyanilino)ethylidene]-1-benzothiophen-3-one

2-[1-(2-Hydroxyanilino)ethylidene]-1-benzothiophen-3-one

C16H13NO2S (283.06669580000005)


   

2-Hydroxyformononetin(1-)

2-Hydroxyformononetin(1-)

C16H11O5- (283.0606456)


   

Prunetin-5-olate

Prunetin-5-olate

C16H11O5- (283.0606456)


A flavonoid oxoanion obtained by deprotonation of the 5-hydroxy group of prunetin. It is the major microspecies at pH 7.3

   
   

(3S,4S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-mercapto-3-oxolanol

(3S,4S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-mercapto-3-oxolanol

C10H13N5O3S (283.07390680000003)


   
   
   

4,7-Dihydroxy-8-methoxyflavone

4,7-Dihydroxy-8-methoxyflavone

C16H11O5- (283.0606456)


   

7,8-Dihydroxy-4-methoxyflavone

7,8-Dihydroxy-4-methoxyflavone

C16H11O5- (283.0606456)


   

(2S,3S,4R,5R)-3,4,5-trihydroxy-6-(pyridine-4-carbonyl)oxane-2-carboxylic acid

(2S,3S,4R,5R)-3,4,5-trihydroxy-6-(pyridine-4-carbonyl)oxane-2-carboxylic acid

C12H13NO7 (283.0691988)


   

4,7-Dihydroxy-3-methoxyflavone

4,7-Dihydroxy-3-methoxyflavone

C16H11O5- (283.0606456)


   
   

3-Phenyl-4-(3-fluorobenzoyl)isoxazol-5(4H)-one

3-Phenyl-4-(3-fluorobenzoyl)isoxazol-5(4H)-one

C16H10FNO3 (283.0644682)


   

3-Phenyl-4-(2-fluorobenzoyl)isoxazol-5(4H)-one

3-Phenyl-4-(2-fluorobenzoyl)isoxazol-5(4H)-one

C16H10FNO3 (283.0644682)


   

ALDH1A3-IN-1

ALDH1A3-IN-1

C13H18BrNO (283.0571678)


ALDH1A3-IN-1 (Compound 14) is a potent ALDH1A3 inhibitor, with an IC50 of 0.63 μM and a Ki of 0.46 μM. ALDH1A3-IN-1 can be studied in prostate cancer[1].

   

Varenicline (dihydrochloride)

Varenicline (dihydrochloride)

C13H15Cl2N3 (283.064297)


Varenicline (CP 526555-18) is an orally active partial agonist of α4β2 nicotinic acetylcholine receptor (α4β2 nAChR, IC50 = 250 nM), which is the principal mediator of nicotine dependence. Varenicline is also a partial agonist of α6β2 nAChR and a full agonist of α6β2 nAChR. Varenicline blocks the direct agonist effects of nicotine on nAChR while stimulates nAChR in a more moderate way, being widely used as an aid of smoking cessation[1][2][3][4][5].

   

5-chloro-3-hydroxy-6-methoxy-1-methyl-3-(2-oxopropyl)indol-2-one

5-chloro-3-hydroxy-6-methoxy-1-methyl-3-(2-oxopropyl)indol-2-one

C13H14ClNO4 (283.0611314)


   

(2r)-2-{[(3,4-dihydroxyphenyl)(hydroxy)methylidene]amino}pentanedioic acid

(2r)-2-{[(3,4-dihydroxyphenyl)(hydroxy)methylidene]amino}pentanedioic acid

C12H13NO7 (283.0691988)


   

2-imino-5-(4-methoxyphenyl)-3-methyl-1h-imidazole-4-sulfonic acid

2-imino-5-(4-methoxyphenyl)-3-methyl-1h-imidazole-4-sulfonic acid

C11H13N3O4S (283.0626738)


   

(3r)-5-chloro-3-hydroxy-6-methoxy-1-methyl-3-(2-oxopropyl)indol-2-one

(3r)-5-chloro-3-hydroxy-6-methoxy-1-methyl-3-(2-oxopropyl)indol-2-one

C13H14ClNO4 (283.0611314)


   

2-{[(3,4-dihydroxyphenyl)(hydroxy)methylidene]amino}pentanedioic acid

2-{[(3,4-dihydroxyphenyl)(hydroxy)methylidene]amino}pentanedioic acid

C12H13NO7 (283.0691988)