| SpectraBase Spectrum ID |
EQh5LXLQnAK |
| Name |
Valproic acid, hexadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.365430784 u |
| Formula |
C24H48O2 |
| InChI |
InChI=1S/C24H48O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-24(25)23(20-5-2)21-6-3/h23H,4-22H2,1-3H3 |
| InChIKey |
NAOJIRIJPNEVOX-UHFFFAOYSA-N |
| Molecular Weight |
368.646 g/mol |
| SMILES |
C(=O)(OCCCCCCCCCCCCCCCC)C(CCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958619 |
