| SpectraBase Spectrum ID |
FkzYNdPZ5qF |
| Name |
oct-3-Enoylamide, N-benzyl-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
315.256214686 u |
| Formula |
C21H33NO |
| InChI |
InChI=1S/C21H33NO/c1-3-5-7-9-13-17-21(23)22(18-14-8-6-4-2)19-20-15-11-10-12-16-20/h9-13,15-16H,3-8,14,17-19H2,1-2H3/b13-9+ |
| InChIKey |
ILMFYNTZHOCJQP-UKTHLTGXSA-N |
| Molecular Weight |
315.501 g/mol |
| SMILES |
C(N(CCCCCC)CC1=CC=CC=C1)(=O)C\C=C\CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971578 |
