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(4Z)-4-(3,4-dichlorobenzylidene)-5-keto-2-methyl-1-p-phenetyl-2-pyrroline-3-carboxylic acid ethyl ester
SpectraBase Compound ID 5g90hcuNb1U
InChI InChI=1S/C23H21Cl2NO4/c1-4-29-17-9-7-16(8-10-17)26-14(3)21(23(28)30-5-2)18(22(26)27)12-15-6-11-19(24)20(25)13-15/h6-13H,4-5H2,1-3H3/b18-12-
InChIKey LMSCRERQRPTMAK-PDGQHHTCSA-N
Mol Weight 446.33 g/mol
Molecular Formula C23H21Cl2NO4
Exact Mass 445.084764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVS792sZkgV
Name (4Z)-4-(3,4-dichlorobenzylidene)-5-keto-2-methyl-1-p-phenetyl-2-pyrroline-3-carboxylic acid ethyl ester
Alternate Name(s) (4Z)-4-[(3,4-dichlorophenyl)methylidene]-1-(4-ethoxyphenyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid ethyl ester Ethyl (4Z)-4-(3,4-dichlorobenzylidene)-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate Ethyl (4Z)-4-[(3,4-dichlorophenyl)methylene]-1-(4-ethoxyphenyl)-2-methyl-5-oxo-pyrrole-3-carboxylate Ethyl (4Z)-4-[(3,4-dichlorophenyl)methylidene]-1-(4-ethoxyphenyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Ethyl (4Z)-4-[(3,4-dichlorophenyl)methylidene]-1-(4-ethoxyphenyl)-2-methyl-5-oxopyrrole-3-carboxylate
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Formula C23H21Cl2NO4
InChI InChI=1S/C23H21Cl2NO4/c1-4-29-17-9-7-16(8-10-17)26-14(3)21(23(28)30-5-2)18(22(26)27)12-15-6-11-19(24)20(25)13-15/h6-13H,4-5H2,1-3H3/b18-12-
InChIKey LMSCRERQRPTMAK-PDGQHHTCSA-N
Molecular Weight 446.330 g/mol
SMILES C=1(\C(C(=O)N(C1C)c1ccc(cc1)OCC)=C\c1cc(Cl)c(cc1)Cl)C(=O)OCC
SPLASH splash10-01ot-7922400000-c2cd2dd65e55d66bcc44
Wiley ID 1443748