SpectraBase Spectrum ID |
KxPIWt1r1FZ |
Name |
Sebacic acid, cis-non-3-enyl pentadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
536.480460537 u |
Formula |
C34H64O4 |
InChI |
InChI=1S/C34H64O4/c1-3-5-7-9-11-12-13-14-15-16-20-24-28-32-38-34(36)30-26-22-18-17-21-25-29-33(35)37-31-27-23-19-10-8-6-4-2/h19,23H,3-18,20-22,24-32H2,1-2H3/b23-19- |
InChIKey |
CETNCJQJNQOQMH-NMWGTECJSA-N |
Molecular Weight |
536.882 g/mol |
SMILES |
C(CCCCCCCCC(OCC\C=C/CCCCC)=O)(OCCCCCCCCCCCCCCC)=O |