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3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-phenyl-, diethyl ester

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

3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-phenyl-, diethyl ester
SpectraBase Compound ID B7WtQh0S9Vk
InChI InChI=1S/C17H19NO4/c1-3-21-16(19)13-10-18-11-14(17(20)22-4-2)15(13)12-8-6-5-7-9-12/h5-11,15,18H,3-4H2,1-2H3
InChIKey BHWJNHBZNDGSIY-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kxd1g4WuJeF
Name 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-phenyl-, diethyl ester
Alternate Name(s) 4-Phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Diethyl 4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS Registry Number 53219-65-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-3-21-16(19)13-10-18-11-14(17(20)22-4-2)15(13)12-8-6-5-7-9-12/h5-11,15,18H,3-4H2,1-2H3
InChIKey BHWJNHBZNDGSIY-UHFFFAOYSA-N
Molecular Weight 301.342 g/mol
SMILES N1C=C(C(C(=C1)C(=O)OCC)c1ccccc1)C(=O)OCC
SPLASH splash10-0udi-0190000000-e896e6f396fb5e27e9bd
Source of Spectrum T-68-4224-0
Wiley ID 1303848