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Ethyl 4-benzoyl-4,5-dihydro-5-oxo-2-phenylpyrrole-3-carboxylate
SpectraBase Compound ID GKgCowN23zO
InChI InChI=1S/C20H17NO4/c1-2-25-20(24)15-16(18(22)14-11-7-4-8-12-14)19(23)21-17(15)13-9-5-3-6-10-13/h3-12,16H,2H2,1H3,(H,21,23)
InChIKey NYHSAJHHWMDTMC-UHFFFAOYSA-N
Mol Weight 335.36 g/mol
Molecular Formula C20H17NO4
Exact Mass 335.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWqFagMPvMC
Name Ethyl 4-benzoyl-4,5-dihydro-5-oxo-2-phenylpyrrole-3-carboxylate
Alternate Name(s) ethyl 4-benzoyl-5-oxo-2-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate 3-benzoyl-2-oxo-5-phenyl-1,3-dihydropyrrole-4-carboxylic acid ethyl ester ethyl 3-benzoyl-2-oxo-5-phenyl-1,3-dihydropyrrole-4-carboxylate ethyl 2-oxidanylidene-5-phenyl-3-(phenylcarbonyl)-1,3-dihydropyrrole-4-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C20H17NO4
InChI InChI=1S/C20H17NO4/c1-2-25-20(24)15-16(18(22)14-11-7-4-8-12-14)19(23)21-17(15)13-9-5-3-6-10-13/h3-12,16H,2H2,1H3,(H,21,23)
InChIKey NYHSAJHHWMDTMC-UHFFFAOYSA-N
Molecular Weight 335.359 g/mol
SMILES N1C(C(C(=C1c1ccccc1)C(=O)OCC)C(c1ccccc1)=O)=O
SPLASH splash10-000i-0096000000-ec924a1df639fbff25b0
Source of Spectrum KC-61-734-9
Wiley ID 1627191