| SpectraBase Spectrum ID |
LAVMoMTQ7Yr |
| Name |
Sebacic acid, cis-non-3-enyl dodecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
494.433510344 u |
| Formula |
C31H58O4 |
| InChI |
InChI=1S/C31H58O4/c1-3-5-7-9-11-12-13-17-21-25-29-35-31(33)27-23-19-15-14-18-22-26-30(32)34-28-24-20-16-10-8-6-4-2/h16,20H,3-15,17-19,21-29H2,1-2H3/b20-16- |
| InChIKey |
QQWHNFQHHNOUNN-SILNSSARSA-N |
| Molecular Weight |
494.801 g/mol |
| SMILES |
C(CCCCCCCCC(OCC\C=C/CCCCC)=O)(OCCCCCCCCCCCC)=O |
