Exact Mass: 333.088

Exact Mass Matches: 333.088

Found 60 metabolites which its exact mass value is equals to given mass value 333.088, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Ethalfluralin

N-Ethyl-N-(2-methyl-2-propenyl)-2,6-dinitro-4-(trifluoromethyl)benzenamine

C13H14F3N3O4 (333.0936)


   

Flurtamone

5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]-2,3-dihydrofuran-3-one

C18H14F3NO2 (333.0977)


   

Flurtamone

Flurtamone

C18H14F3NO2 (333.0977)


CONFIDENCE standard compound; INTERNAL_ID 2318 CONFIDENCE standard compound; INTERNAL_ID 8438 CONFIDENCE standard compound; INTERNAL_ID 4064 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3600 EAWAG_UCHEM_ID 3600; CONFIDENCE standard compound

   
   

fumimycin

fumimycin

C16H15NO7 (333.0848)


A member of the class of 1-benzofurans that is 1-benzofuran-2(3H)-one substituted by a propenyl group at position 4, hydroxy groups at positions 5 and 6, methyl group at position 3 and a [(2E)-3-carboxyprop-2-enoyl]nitrilo group at position 3. Isolated from the fermentation broth of Aspergillus fumisynnematus F746, it exhibits antibacterial activity.

   

galloyl L-tyrosine

galloyl L-tyrosine

C16H15NO7 (333.0848)


   

CI-959

CI-959 free acid

C14H15N5O3S (333.0896)


CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4644; ORIGINAL_PRECURSOR_SCAN_NO 4643 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4658; ORIGINAL_PRECURSOR_SCAN_NO 4656 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4623; ORIGINAL_PRECURSOR_SCAN_NO 4622 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4643; ORIGINAL_PRECURSOR_SCAN_NO 4641 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4743; ORIGINAL_PRECURSOR_SCAN_NO 4742 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4666; ORIGINAL_PRECURSOR_SCAN_NO 4664 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9102; ORIGINAL_PRECURSOR_SCAN_NO 9101 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9117; ORIGINAL_PRECURSOR_SCAN_NO 9116 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9137; ORIGINAL_PRECURSOR_SCAN_NO 9136 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9164; ORIGINAL_PRECURSOR_SCAN_NO 9162 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9184; ORIGINAL_PRECURSOR_SCAN_NO 9183 CONFIDENCE standard compound; INTERNAL_ID 1187; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9157; ORIGINAL_PRECURSOR_SCAN_NO 9156

   

2-amino-6-(4-fluorophenyl)-3-nitro-4-phenylbenzonitrile

2-amino-6-(4-fluorophenyl)-3-nitro-4-phenylbenzonitrile

C19H12FN3O2 (333.0914)


   

3-PHENYL-1-(PHENYLSULFONYL)INDOLE

3-PHENYL-1-(PHENYLSULFONYL)INDOLE

C20H15NO2S (333.0823)


   

tert-Butyl 3-(bromomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate

tert-Butyl 3-(bromomethyl)-2-oxa-8-azaspiro[4.5]decane-8-carboxylate

C14H24BrNO3 (333.0939)


   

Thiazolidine, 2-(4-methylphenyl)-3-[(3-methylphenyl)sulfonyl]- (9CI)

Thiazolidine, 2-(4-methylphenyl)-3-[(3-methylphenyl)sulfonyl]- (9CI)

C17H19NO2S2 (333.0857)


   

CefepiMe interMediate (7-PIME)

CefepiMe interMediate (7-PIME)

C13H20ClN3O3S (333.0914)


   

(R)-Duloxetine

(R)-Duloxetine Hydrochloride

C18H20ClNOS (333.0954)


D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D000068760 - Serotonin and Noradrenaline Reuptake Inhibitors D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators

   

Thiazolidine, 2-(2,3-dihydro-1H-phenalen-6-yl)-3-(methylsulfonyl)- (9CI)

Thiazolidine, 2-(2,3-dihydro-1H-phenalen-6-yl)-3-(methylsulfonyl)- (9CI)

C17H19NO2S2 (333.0857)


   

3-[(2-chloro-6-fluorophenyl)methyl]-7,7-dimethyl-6,8-dihydro-1H-quinoline-2,5-dione

3-[(2-chloro-6-fluorophenyl)methyl]-7,7-dimethyl-6,8-dihydro-1H-quinoline-2,5-dione

C18H17ClFNO2 (333.0932)


   

BCAT BENZOTRIAZOLE-1-CARBOXAMIDINIUM TOSYLATE

BCAT BENZOTRIAZOLE-1-CARBOXAMIDINIUM TOSYLATE

C14H15N5O3S (333.0896)


   

Duloxetine hydrochloride

(RS)-Duloxetine hydrochloride

C18H20ClNOS (333.0954)


D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D000068760 - Serotonin and Noradrenaline Reuptake Inhibitors D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent D002491 - Central Nervous System Agents > D000700 - Analgesics D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators

   

tert-butyl 4-(trifluoromethylsulfonyloxy)piperidine-1-carboxylate

tert-butyl 4-(trifluoromethylsulfonyloxy)piperidine-1-carboxylate

C11H18F3NO5S (333.0858)


   

4-[3-(Methylamino)-1-(2-thienyl)propyl]-1-naphthalenol hydrochloride

4-[3-(Methylamino)-1-(2-thienyl)propyl]-1-naphthalenol hydrochloride

C18H20ClNOS (333.0954)


   

Thiazolidine, 2-(4-methylphenyl)-3-[(4-methylphenyl)sulfonyl]- (9CI)

Thiazolidine, 2-(4-methylphenyl)-3-[(4-methylphenyl)sulfonyl]- (9CI)

C17H19NO2S2 (333.0857)


   

4-(N-[2,4-Diamino-6-pteridinylmethyl]amino)benzoic acid sodium salt

4-(N-[2,4-Diamino-6-pteridinylmethyl]amino)benzoic acid sodium salt

C14H12N7NaO2 (333.095)


   

2-chloro-9-[3-(dimethylamino)propyl]thioxanthen-9-ol

2-chloro-9-[3-(dimethylamino)propyl]thioxanthen-9-ol

C18H20ClNOS (333.0954)


   

Picibanil

Picibanil

C16H17N2O4S- (333.0909)


C308 - Immunotherapeutic Agent > C210 - Immunoadjuvant > C2141 - Chemo Immunostimulant Adjuvant D000970 - Antineoplastic Agents C2140 - Adjuvant

   

(RS)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)pyrimidine-2,4-dione

(RS)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)pyrimidine-2,4-dione

C15H15N3O6 (333.0961)


   

2-[4-(4-Fluorobenzoyl)phenyl]-2-(4-fluorophenyl)acetonitrile

2-[4-(4-Fluorobenzoyl)phenyl]-2-(4-fluorophenyl)acetonitrile

C21H13F2NO (333.0965)


   

3-(1-Benzotriazolylmethyl)-6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

3-(1-Benzotriazolylmethyl)-6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

C16H11N7S (333.0797)


   

N-[3-(7-methyl-2-imidazo[1,2-a]pyridinyl)phenyl]-2-thiophenecarboxamide

N-[3-(7-methyl-2-imidazo[1,2-a]pyridinyl)phenyl]-2-thiophenecarboxamide

C19H15N3OS (333.0936)


   

Chromophore (asp-tyr-gly)

Chromophore (asp-tyr-gly)

C15H15N3O6 (333.0961)


   

7-demethylmitomycin B(2-)

7-demethylmitomycin B(2-)

C15H15N3O6-2 (333.0961)


   

7-demethylmitomycin A(2-)

7-demethylmitomycin A(2-)

C15H15N3O6-2 (333.0961)


   

1-[5-[4-(Methylthio)phenyl]-2-thiazolyl]-4-piperidinecarboxamide

1-[5-[4-(Methylthio)phenyl]-2-thiazolyl]-4-piperidinecarboxamide

C16H19N3OS2 (333.0969)


   

(2S)-2-{[(2-benzyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]amino}-3-methyl-3-sulfanylbutanoate

(2S)-2-{[(2-benzyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]amino}-3-methyl-3-sulfanylbutanoate

C16H17N2O4S- (333.0909)


   

3-methyl-N,6-diphenyl-2-imidazo[2,1-b]thiazolecarboxamide

3-methyl-N,6-diphenyl-2-imidazo[2,1-b]thiazolecarboxamide

C19H15N3OS (333.0936)


   

2-[4-(4-Chloro-2-nitrophenyl)-1-piperazinyl]phenol

2-[4-(4-Chloro-2-nitrophenyl)-1-piperazinyl]phenol

C16H16ClN3O3 (333.088)


   

N-[2-(1H-benzimidazol-2-yl)phenyl]-2-thiophen-2-ylacetamide

N-[2-(1H-benzimidazol-2-yl)phenyl]-2-thiophen-2-ylacetamide

C19H15N3OS (333.0936)


   

1-(2-Benzofuranyl)-2-[(4-methyl-2-quinolinyl)thio]ethanone

1-(2-Benzofuranyl)-2-[(4-methyl-2-quinolinyl)thio]ethanone

C20H15NO2S (333.0823)


   

1-(3-Methylphenyl)-3-[[oxo-(5-propyl-3-thiophenyl)methyl]amino]thiourea

1-(3-Methylphenyl)-3-[[oxo-(5-propyl-3-thiophenyl)methyl]amino]thiourea

C16H19N3OS2 (333.0969)


   

1-[4-[4-(Methylthio)phenyl]-2-thiazolyl]-4-piperidinecarboxamide

1-[4-[4-(Methylthio)phenyl]-2-thiazolyl]-4-piperidinecarboxamide

C16H19N3OS2 (333.0969)


   
   

(2S)-5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3(2H)-one

(2S)-5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3(2H)-one

C18H14F3NO2 (333.0977)


   

N-[2-[(2Z)-2-[(2-hydroxy-3-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]thiophene-2-carboxamide

N-[2-[(2Z)-2-[(2-hydroxy-3-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]thiophene-2-carboxamide

C15H15N3O4S (333.0783)


   
   

benzylpenicillin(1-)

benzylpenicillin(1-)

C16H17N2O4S (333.0909)


   

7-demethylmitomycin B(2-)

7-demethylmitomycin B(2-)

C15H15N3O6 (333.0961)


A phenolate anion obtained by removal of two protons from position C-8 and O-6 of 7-demethylmitomycin B. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).

   

7-demethylmitomycin A(2-)

7-demethylmitomycin A(2-)

C15H15N3O6 (333.0961)


A phenolate anion obtained by removal of two protons from position C-8 and O-6 of 7-demethylmitomycin A. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).

   

benzylpenicillenate

benzylpenicillenate

C16H17N2O4S (333.0909)


The conjugate base of benzylpenicillenic acid.

   

B-Raf IN 15

B-Raf IN 15

C19H15N3OS (333.0936)


B-Raf IN 15 (Compound 7) is a BRAF inhibitor. B-Raf IN 15 inhibits BRAF WT and BRAF V600E with IC50s of 2.0 and 0.8 μM. B-Raf IN 15 can be used for the research of cancer[1].

   

2-amino-1,7-dihydroxy-3,9-dimethoxy-1-methylbenzo[c]chromene-4,6-dione

2-amino-1,7-dihydroxy-3,9-dimethoxy-1-methylbenzo[c]chromene-4,6-dione

C16H15NO7 (333.0848)


   

n-[(1z)-2-[(4as,6s,8ar)-6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl]ethenyl]-1-chloromethanecarbonimidoyl chloride

n-[(1z)-2-[(4as,6s,8ar)-6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl]ethenyl]-1-chloromethanecarbonimidoyl chloride

C16H22Cl3N (333.0818)


   

n-[(1e)-2-[(4ar,6s,8ar)-6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl]ethenyl]-1-chloromethanecarbonimidoyl chloride

n-[(1e)-2-[(4ar,6s,8ar)-6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl]ethenyl]-1-chloromethanecarbonimidoyl chloride

C16H22Cl3N (333.0818)


   

(2e)-3-({5,6-dihydroxy-3-methyl-2-oxo-4-[(1e)-prop-1-en-1-yl]-1-benzofuran-3-yl}-c-hydroxycarbonimidoyl)prop-2-enoic acid

(2e)-3-({5,6-dihydroxy-3-methyl-2-oxo-4-[(1e)-prop-1-en-1-yl]-1-benzofuran-3-yl}-c-hydroxycarbonimidoyl)prop-2-enoic acid

C16H15NO7 (333.0848)


   

1-chloro-n-[2-(6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl)ethenyl]methanecarbonimidoyl chloride

1-chloro-n-[2-(6-chloro-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-yl)ethenyl]methanecarbonimidoyl chloride

C16H22Cl3N (333.0818)


   

(2s)-2-amino-3-[4-(3,4,5-trihydroxybenzoyloxy)phenyl]propanoic acid

(2s)-2-amino-3-[4-(3,4,5-trihydroxybenzoyloxy)phenyl]propanoic acid

C16H15NO7 (333.0848)


   

3-{[5,6-dihydroxy-3-methyl-2-oxo-4-(prop-1-en-1-yl)-1-benzofuran-3-yl]-c-hydroxycarbonimidoyl}prop-2-enoic acid

3-{[5,6-dihydroxy-3-methyl-2-oxo-4-(prop-1-en-1-yl)-1-benzofuran-3-yl]-c-hydroxycarbonimidoyl}prop-2-enoic acid

C16H15NO7 (333.0848)


   

methyl (2s)-3-{[(2r)-2-hydroxy-3-methoxy-3-oxopropyl]sulfanyl}-2-[(3r)-3-methyl-2,5-dioxopyrrolidin-1-yl]propanoate

methyl (2s)-3-{[(2r)-2-hydroxy-3-methoxy-3-oxopropyl]sulfanyl}-2-[(3r)-3-methyl-2,5-dioxopyrrolidin-1-yl]propanoate

C13H19NO7S (333.0882)


   

methyl 2-hydroxy-3-{[3-methoxy-2-(3-methyl-2,5-dioxopyrrolidin-1-yl)-3-oxopropyl]sulfanyl}propanoate

methyl 2-hydroxy-3-{[3-methoxy-2-(3-methyl-2,5-dioxopyrrolidin-1-yl)-3-oxopropyl]sulfanyl}propanoate

C13H19NO7S (333.0882)


   

(2s)-2-{[hydroxy(3,4,5-trihydroxyphenyl)methylidene]amino}-3-(4-hydroxyphenyl)propanoic acid

(2s)-2-{[hydroxy(3,4,5-trihydroxyphenyl)methylidene]amino}-3-(4-hydroxyphenyl)propanoic acid

C16H15NO7 (333.0848)


   

(1r)-2-amino-1,7-dihydroxy-3,9-dimethoxy-1-methylbenzo[c]chromene-4,6-dione

(1r)-2-amino-1,7-dihydroxy-3,9-dimethoxy-1-methylbenzo[c]chromene-4,6-dione

C16H15NO7 (333.0848)


   

(2e)-3-{[(3s)-5,6-dihydroxy-3-methyl-2-oxo-4-[(1e)-prop-1-en-1-yl]-1-benzofuran-3-yl]-c-hydroxycarbonimidoyl}prop-2-enoic acid

(2e)-3-{[(3s)-5,6-dihydroxy-3-methyl-2-oxo-4-[(1e)-prop-1-en-1-yl]-1-benzofuran-3-yl]-c-hydroxycarbonimidoyl}prop-2-enoic acid

C16H15NO7 (333.0848)