SpectraBase Spectrum ID |
DZbMAsBouVP |
Name |
N-[(1E,3E)-5-Phenyl-2-benzyl-1,3-pentadienyl)-acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.162314299 u |
Formula |
C20H21NO |
InChI |
InChI=1S/C20H21NO/c1-17(22)21-16-20(15-19-11-6-3-7-12-19)14-8-13-18-9-4-2-5-10-18/h2-12,14,16H,13,15H2,1H3,(H,21,22)/b14-8+,20-16- |
InChIKey |
FCFQVYCCOSHDDP-FUCZQVAVSA-N |
SMILES |
C(N\C=C\(\C=C\CC=1C=CC=CC1)CC1=CC=CC=C1)(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908257 |