| SpectraBase Spectrum ID |
Juir0M7Meej |
| Name |
Benzoic acid, 4-propyl-, tetradecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.302830526 u |
| Formula |
C24H40O2 |
| InChI |
InChI=1S/C24H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-21-26-24(25)23-19-17-22(16-4-2)18-20-23/h17-20H,3-16,21H2,1-2H3 |
| InChIKey |
KHEUTIARXHKJTJ-UHFFFAOYSA-N |
| Molecular Weight |
360.582 g/mol |
| SMILES |
C(OCCCCCCCCCCCCCC)(=O)C1=CC=C(CCC)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888594 |
