| SpectraBase Spectrum ID |
XWbMSHElyk |
| Name |
Propionamide, 3-phenyl-N-butyl-N-isobutyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.209264492 u |
| Formula |
C17H27NO |
| InChI |
InChI=1S/C17H27NO/c1-4-5-13-18(14-15(2)3)17(19)12-11-16-9-7-6-8-10-16/h6-10,15H,4-5,11-14H2,1-3H3 |
| InChIKey |
CKVOOOOJALNWOK-UHFFFAOYSA-N |
| Molecular Weight |
261.409 g/mol |
| SMILES |
C(=O)(N(CCCC)CC(C)C)CCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.874142 |
