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

*Links on SpectraBase are not permalinks.

2,6-Pyridinedicarboxylic acid, neopentyl tridecyl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, neopentyl tridecyl ester
SpectraBase Compound ID DQZPk4eu7JM
InChI InChI=1S/C25H41NO4/c1-5-6-7-8-9-10-11-12-13-14-15-19-29-23(27)21-17-16-18-22(26-21)24(28)30-20-25(2,3)4/h16-18H,5-15,19-20H2,1-4H3
InChIKey BIIBAFULBBITQF-UHFFFAOYSA-N
Mol Weight 419.6 g/mol
Molecular Formula C25H41NO4
Exact Mass 419.303559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID HKZLX3LJfdv
Name 2,6-Pyridinedicarboxylic acid, neopentyl tridecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.303558800 u
Formula C25H41NO4
InChI InChI=1S/C25H41NO4/c1-5-6-7-8-9-10-11-12-13-14-15-19-29-23(27)21-17-16-18-22(26-21)24(28)30-20-25(2,3)4/h16-18H,5-15,19-20H2,1-4H3
InChIKey BIIBAFULBBITQF-UHFFFAOYSA-N
Molecular Weight 419.606 g/mol
SMILES CCCCCCCCCCCCCOC(C=1N=C(C(OCC(C)(C)C)=O)C=CC1)=O