| SpectraBase Spectrum ID |
9SD0JzXSCwx |
| Name |
Valeramide, N-allyl-N-propyl-5-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
259.193614428 u |
| Formula |
C17H25NO |
| InChI |
InChI=1S/C17H25NO/c1-3-14-18(15-4-2)17(19)13-9-8-12-16-10-6-5-7-11-16/h3,5-7,10-11H,1,4,8-9,12-15H2,2H3 |
| InChIKey |
QHUYZNQVUDDMJH-UHFFFAOYSA-N |
| Molecular Weight |
259.393 g/mol |
| SMILES |
C(N(CCC)CC=C)(=O)CCCCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941439 |
