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

*Links on SpectraBase are not permalinks.

2,6-Pyridinedicarboxylic acid, isobutyl undecyl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, isobutyl undecyl ester
SpectraBase Compound ID C4BS3fiUoEX
InChI InChI=1S/C22H35NO4/c1-4-5-6-7-8-9-10-11-12-16-26-21(24)19-14-13-15-20(23-19)22(25)27-17-18(2)3/h13-15,18H,4-12,16-17H2,1-3H3
InChIKey YGLGDKLEQMLMIN-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C22H35NO4
Exact Mass 377.256609 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 KGd9lyszMav
Name 2,6-Pyridinedicarboxylic acid, isobutyl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.256608607 u
Formula C22H35NO4
InChI InChI=1S/C22H35NO4/c1-4-5-6-7-8-9-10-11-12-16-26-21(24)19-14-13-15-20(23-19)22(25)27-17-18(2)3/h13-15,18H,4-12,16-17H2,1-3H3
InChIKey YGLGDKLEQMLMIN-UHFFFAOYSA-N
Molecular Weight 377.525 g/mol
SMILES CCCCCCCCCCCOC(C=1N=C(C(OCC(C)C)=O)C=CC1)=O