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

*Links on SpectraBase are not permalinks.

2,6-Pyridinedicarboxylic acid, 3,5-dichlorobenzyl nonyl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, 3,5-dichlorobenzyl nonyl ester
SpectraBase Compound ID Bjoeuf3d8u8
InChI InChI=1S/C23H27Cl2NO4/c1-2-3-4-5-6-7-8-12-29-22(27)20-10-9-11-21(26-20)23(28)30-16-17-13-18(24)15-19(25)14-17/h9-11,13-15H,2-8,12,16H2,1H3
InChIKey GWWGYKDCICSRRI-UHFFFAOYSA-N
Mol Weight 452.38 g/mol
Molecular Formula C23H27Cl2NO4
Exact Mass 451.131714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID KI9KZ04bcQ2
Name 2,6-Pyridinedicarboxylic acid, 3,5-dichlorobenzyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.131713749 u
Formula C23H27Cl2NO4
InChI InChI=1S/C23H27Cl2NO4/c1-2-3-4-5-6-7-8-12-29-22(27)20-10-9-11-21(26-20)23(28)30-16-17-13-18(24)15-19(25)14-17/h9-11,13-15H,2-8,12,16H2,1H3
InChIKey GWWGYKDCICSRRI-UHFFFAOYSA-N
Molecular Weight 452.378 g/mol
SMILES CCCCCCCCCOC(C=1N=C(C(OCC2=CC(=CC(=C2)Cl)Cl)=O)C=CC1)=O