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1-(4-Ethoxyphenyl)-4-(4-methoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

1-(4-Ethoxyphenyl)-4-(4-methoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID LxsZcDXAUny
InChI InChI=1S/C26H29NO6/c1-5-31-21-14-10-19(11-15-21)27-16-22(25(28)32-6-2)24(23(17-27)26(29)33-7-3)18-8-12-20(30-4)13-9-18/h8-17,24H,5-7H2,1-4H3
InChIKey BEQTXAKGLREIMY-UHFFFAOYSA-N
Mol Weight 451.52 g/mol
Molecular Formula C26H29NO6
Exact Mass 451.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDYJ1RdymFz
Name 1-(4-Ethoxyphenyl)-4-(4-methoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 451.199487652 u
Formula C26H29NO6
InChI InChI=1S/C26H29NO6/c1-5-31-21-14-10-19(11-15-21)27-16-22(25(28)32-6-2)24(23(17-27)26(29)33-7-3)18-8-12-20(30-4)13-9-18/h8-17,24H,5-7H2,1-4H3
InChIKey BEQTXAKGLREIMY-UHFFFAOYSA-N
Molecular Weight 451.519 g/mol
SMILES C1(=CN(C2=CC=C(C=C2)OCC)C=C(C1C=1C=CC(=CC1)OC)C(=O)OCC)C(=O)OCC