| SpectraBase Spectrum ID |
87VUdCM8e2K |
| Name |
Fumaric acid, allyl hexadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.292659764 u |
| Formula |
C23H40O4 |
| InChI |
InChI=1S/C23H40O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-23(25)19-18-22(24)26-20-4-2/h4,18-19H,2-3,5-17,20-21H2,1H3/b19-18+ |
| InChIKey |
DYRWLRHUIPTERM-VHEBQXMUSA-N |
| Molecular Weight |
380.569 g/mol |
| SMILES |
C(CCOC(\C=C\C(OCC=C)=O)=O)CCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94342 |
