| SpectraBase Spectrum ID |
3L0qwxbcjbl |
| Name |
3-Methyl-2-butenoic acid, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.287180462 u |
| Formula |
C20H38O2 |
| InChI |
InChI=1S/C20H38O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-20(21)18-19(2)3/h18H,4-17H2,1-3H3 |
| InChIKey |
PQUFHXIWUXLGDG-UHFFFAOYSA-N |
| Molecular Weight |
310.522 g/mol |
| SMILES |
CCCCCCCCCCCCCCCOC(=O)C=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918407 |
