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4-(2,3-dichlorophenyl)-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID J7DpJLtWdNy
InChI InChI=1S/C23H21Cl2NO4/c1-14(15-8-5-4-6-9-15)26-12-17(22(27)29-2)20(18(13-26)23(28)30-3)16-10-7-11-19(24)21(16)25/h4-14,20H,1-3H3
InChIKey CDTXCOXNRRFCAW-UHFFFAOYSA-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 EAItPJeqRRm
Name 4-(2,3-dichlorophenyl)-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-(2,3-dichlorophenyl)-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylate Dimethyl 4-[2,3-bis(chloranyl)phenyl]-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylate
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Formula C23H21Cl2NO4
InChI InChI=1S/C23H21Cl2NO4/c1-14(15-8-5-4-6-9-15)26-12-17(22(27)29-2)20(18(13-26)23(28)30-3)16-10-7-11-19(24)21(16)25/h4-14,20H,1-3H3
InChIKey CDTXCOXNRRFCAW-UHFFFAOYSA-N
Molecular Weight 446.330 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)C(c1ccccc1)C)c1c(c(Cl)ccc1)Cl)C(=O)OC
SPLASH splash10-0a4i-3901000000-1be2d05fdde4286dc127
Wiley ID 1461695