| SpectraBase Spectrum ID |
EmdLKdbZpnd |
| Name |
Propionamide, N-allyl-N-butyl-3-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.177964364 u |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-3-5-14-17(13-4-2)16(18)12-11-15-9-7-6-8-10-15/h4,6-10H,2-3,5,11-14H2,1H3 |
| InChIKey |
VMYKROVPRZKWIW-UHFFFAOYSA-N |
| Molecular Weight |
245.366 g/mol |
| SMILES |
C(N(CCCC)CC=C)(=O)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950158 |
