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Diethyl 4-(4-chlorophenyl)-1-(4-methoxyphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
SpectraBase Compound ID 1PAVmGADB1Z
InChI InChI=1S/C26H28ClNO5/c1-6-32-25(29)22-16(3)28(20-12-14-21(31-5)15-13-20)17(4)23(26(30)33-7-2)24(22)18-8-10-19(27)11-9-18/h8-15,24H,6-7H2,1-5H3
InChIKey BDFKTLSPKYBMCX-UHFFFAOYSA-N
Mol Weight 469.97 g/mol
Molecular Formula C26H28ClNO5
Exact Mass 469.165601 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImdCK0jTGgU
Name Diethyl 4-(4-chlorophenyl)-1-(4-methoxyphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 469.165600701 u
Formula C26H28ClNO5
InChI InChI=1S/C26H28ClNO5/c1-6-32-25(29)22-16(3)28(20-12-14-21(31-5)15-13-20)17(4)23(26(30)33-7-2)24(22)18-8-10-19(27)11-9-18/h8-15,24H,6-7H2,1-5H3
InChIKey BDFKTLSPKYBMCX-UHFFFAOYSA-N
Molecular Weight 469.965 g/mol
SMILES C1(=C(N(C2=CC=C(C=C2)OC)C(=C(C1C=1C=CC(=CC1)Cl)C(=O)OCC)C)C)C(=O)OCC