For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Pyridinecarboxylic acid, 5-[N-(ethoxycarbonyl)-P,P-diphenylphosphinimyl]-1,2-dihydro-6-(4-methylphenyl)-2-oxo-, methyl ester

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

4-Pyridinecarboxylic acid, 5-[N-(ethoxycarbonyl)-P,P-diphenylphosphinimyl]-1,2-dihydro-6-(4-methylphenyl)-2-oxo-, methyl ester
SpectraBase Compound ID DorNn7hfwz8
InChI InChI=1S/C29H27N2O5P/c1-4-36-29(34)31-37(22-11-7-5-8-12-22,23-13-9-6-10-14-23)27-24(28(33)35-3)19-25(32)30-26(27)21-17-15-20(2)16-18-21/h5-19H,4H2,1-3H3,(H,30,32)
InChIKey XUOSLQXJDFQHTC-UHFFFAOYSA-N
Mol Weight 514.52 g/mol
Molecular Formula C29H27N2O5P
Exact Mass 514.165759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IyMlndZFubX
Name 4-Pyridinecarboxylic acid, 5-[N-(ethoxycarbonyl)-P,P-diphenylphosphinimyl]-1,2-dihydro-6-(4-methylphenyl)-2-oxo-, methyl ester
CAS Registry Number 126574-31-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H27N2O5P
InChI InChI=1S/C29H27N2O5P/c1-4-36-29(34)31-37(22-11-7-5-8-12-22,23-13-9-6-10-14-23)27-24(28(33)35-3)19-25(32)30-26(27)21-17-15-20(2)16-18-21/h5-19H,4H2,1-3H3,(H,30,32)
InChIKey XUOSLQXJDFQHTC-UHFFFAOYSA-N
Molecular Weight 514.518 g/mol
SMILES N1C(C=C(C(=C1c1ccc(C)cc1)P(=NC(=O)OCC)(c1ccccc1)c1ccccc1)C(=O)OC)=O
SPLASH splash10-0006-0000910000-2a2c0a98f88ea8223f35
Source of Spectrum KC-1989-2276-10
Synonyms 5-[Ethoxycarbonylimino(diphenyl)-.lambda.(5)-phosphanyl]-4-methoxycarbonyl-2-oxo-6 (p-tolyl)-1,2-dihydropyridine
Wiley ID 1401128