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4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID ABEsOScHrwQ
InChI InChI=1S/C21H22N2O3/c1-4-26-21(25)19-13-18(22-16-9-5-14(2)6-10-16)20(24)23(19)17-11-7-15(3)8-12-17/h5-13,19,22H,4H2,1-3H3
InChIKey ONXLDZYERFHUAK-UHFFFAOYSA-N
Mol Weight 350.42 g/mol
Molecular Formula C21H22N2O3
Exact Mass 350.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoVwcKHNage
Name 4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrole-2-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C21H22N2O3
InChI InChI=1S/C21H22N2O3/c1-4-26-21(25)19-13-18(22-16-9-5-14(2)6-10-16)20(24)23(19)17-11-7-15(3)8-12-17/h5-13,19,22H,4H2,1-3H3
InChIKey ONXLDZYERFHUAK-UHFFFAOYSA-N
Molecular Weight 350.418 g/mol
SMILES N(C=1C(N(C(C1)C(=O)OCC)c1ccc(cc1)C)=O)c1ccc(cc1)C
SPLASH splash10-0fb9-0094000000-d8e589b2b0e61a567595
Source of Spectrum K1-0-2847-1
Synonyms 5-keto-4-(p-toluidino)-1-(p-tolyl)-3-pyrroline-2-carboxylic acid ethyl ester ethyl 1-(4-methylphenyl)-4-[(4-methylphenyl)amino]-5-oxidanylidene-2H-pyrrole-2-carboxylate ethyl 4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrole-2-carboxylate ethyl 4-(4-methylanilino)-5-oxo-1-(p-tolyl)-2H-pyrrole-2-carboxylate
Wiley ID 1589022