| SpectraBase Spectrum ID |
4hLvT48KNCY |
| Name |
Fumaric acid, dec-4-enyl hexadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
478.402210215 u |
| Formula |
C30H54O4 |
| InChI |
InChI=1S/C30H54O4/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-28-34-30(32)26-25-29(31)33-27-23-21-19-12-10-8-6-4-2/h12,19,25-26H,3-11,13-18,20-24,27-28H2,1-2H3/b19-12+,26-25+ |
| InChIKey |
HPGVPOJYSBDRGF-WISIHWMRSA-N |
| Molecular Weight |
478.758 g/mol |
| SMILES |
C(OCCC\C=C\CCCCC)(\C=C\C(OCCCCCCCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968882 |
