| SpectraBase Spectrum ID |
4BLODoTH7Kw |
| Name |
oct-3-Enoylamide, N-benzyl-N-propyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
273.209264492 u |
| Formula |
C18H27NO |
| InChI |
InChI=1S/C18H27NO/c1-3-5-6-7-11-14-18(20)19(15-4-2)16-17-12-9-8-10-13-17/h7-13H,3-6,14-16H2,1-2H3/b11-7+ |
| InChIKey |
GCVRBHOMYBDUBV-YRNVUSSQSA-N |
| Molecular Weight |
273.420 g/mol |
| SMILES |
C(N(CCC)CC1=CC=CC=C1)(=O)C\C=C\CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963819 |
