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

*Links on SpectraBase are not permalinks.

2,6-Pyridinedicarboxylic acid, 5-methoxy-3-methylpent-2-yl undecyl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, 5-methoxy-3-methylpent-2-yl undecyl ester
SpectraBase Compound ID JMn1b5QTbkn
InChI InChI=1S/C25H41NO5/c1-5-6-7-8-9-10-11-12-13-18-30-24(27)22-15-14-16-23(26-22)25(28)31-21(3)20(2)17-19-29-4/h14-16,20-21H,5-13,17-19H2,1-4H3
InChIKey BOBQFBJNGUFICP-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C25H41NO5
Exact Mass 435.298473 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 EzWciijKtRL
Name 2,6-Pyridinedicarboxylic acid, 5-methoxy-3-methylpent-2-yl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.298473419 u
Formula C25H41NO5
InChI InChI=1S/C25H41NO5/c1-5-6-7-8-9-10-11-12-13-18-30-24(27)22-15-14-16-23(26-22)25(28)31-21(3)20(2)17-19-29-4/h14-16,20-21H,5-13,17-19H2,1-4H3
InChIKey BOBQFBJNGUFICP-UHFFFAOYSA-N
Molecular Weight 435.605 g/mol
SMILES CC(OC(C1=NC(C(OCCCCCCCCCCC)=O)=CC=C1)=O)C(CCOC)C