| SpectraBase Spectrum ID |
LVOHps040Jz |
| Name |
Fumaric acid, 5-methoxy-3-phenylpentyl decyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.287574383 u |
| Formula |
C26H40O5 |
| InChI |
InChI=1S/C26H40O5/c1-3-4-5-6-7-8-9-13-20-30-25(27)16-17-26(28)31-22-19-24(18-21-29-2)23-14-11-10-12-15-23/h10-12,14-17,24H,3-9,13,18-22H2,1-2H3/b17-16+ |
| InChIKey |
OGAGNQXLGBZLOM-WUKNDPDISA-N |
| Molecular Weight |
432.601 g/mol |
| SMILES |
C(OCCC(CCOC)C1=CC=CC=C1)(\C=C\C(OCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844318 |
