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

*Links on SpectraBase are not permalinks.

Sebacic acid, pentadecyl undecyl ester

View entire compound with spectra: 1 NMR

Sebacic acid, pentadecyl undecyl ester
SpectraBase Compound ID 334WAb82LF6
InChI InChI=1S/C36H70O4/c1-3-5-7-9-11-13-14-15-16-18-22-26-30-34-40-36(38)32-28-24-20-19-23-27-31-35(37)39-33-29-25-21-17-12-10-8-6-4-2/h3-34H2,1-2H3
InChIKey BCEJDRBJGLGNBJ-UHFFFAOYSA-N
Mol Weight 567.0 g/mol
Molecular Formula C36H70O4
Exact Mass 566.527411 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 CULC3gXkxXW
Name Sebacic acid, pentadecyl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 566.527410730 u
Formula C36H70O4
InChI InChI=1S/C36H70O4/c1-3-5-7-9-11-13-14-15-16-18-22-26-30-34-40-36(38)32-28-24-20-19-23-27-31-35(37)39-33-29-25-21-17-12-10-8-6-4-2/h3-34H2,1-2H3
InChIKey BCEJDRBJGLGNBJ-UHFFFAOYSA-N
Molecular Weight 566.952 g/mol
SMILES C(CCCCCCC(OCCCCCCCCCCCCCCC)=O)CC(OCCCCCCCCCCC)=O