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1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylic acid, 2-(4-(diphenylmethyl)-1-piperazinyl]ethyl methyl ester
SpectraBase Compound ID FhCywAkdYMl
InChI InChI=1S/C35H38N4O6.2ClH/c1-24-30(34(40)44-3)32(28-15-10-16-29(23-28)39(42)43)31(25(2)36-24)35(41)45-22-21-37-17-19-38(20-18-37)33(26-11-6-4-7-12-26)27-13-8-5-9-14-27;;/h4-16,23,32-33,36H,17-22H2,1-3H3;2*1H
InChIKey JINNGBXKBDUGQT-UHFFFAOYSA-N
Mol Weight 683.6 g/mol
Molecular Formula C35H40Cl2N4O6
Exact Mass 682.23249 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HqYz98B92Gm
Name 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylic acid, 2-(4-(diphenylmethyl)-1-piperazinyl]ethyl methyl ester
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Formula C35H40Cl2N4O6
InChI InChI=1S/C35H38N4O6.2ClH/c1-24-30(34(40)44-3)32(28-15-10-16-29(23-28)39(42)43)31(25(2)36-24)35(41)45-22-21-37-17-19-38(20-18-37)33(26-11-6-4-7-12-26)27-13-8-5-9-14-27;;/h4-16,23,32-33,36H,17-22H2,1-3H3;2*1H
InChIKey JINNGBXKBDUGQT-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 49197M
Solvent DMSO-d6