| SpectraBase Spectrum ID |
44V49quyHoL |
| Name |
Benzamide, 2,4-dimethyl-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
233.177964364 u |
| Formula |
C15H23NO |
| InChI |
InChI=1S/C15H23NO/c1-4-5-6-7-10-16-15(17)14-9-8-12(2)11-13(14)3/h8-9,11H,4-7,10H2,1-3H3,(H,16,17) |
| InChIKey |
FXHJFWJISJTZSP-UHFFFAOYSA-N |
| Molecular Weight |
233.355 g/mol |
| SMILES |
C(CNC(=O)C1=C(C)C=C(C)C=C1)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94746 |