| SpectraBase Spectrum ID |
IvSNDSf5HKl |
| Name |
Propionamide, 3-cyclopentyl-N-benzyl-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
315.256214686 u |
| Formula |
C21H33NO |
| InChI |
InChI=1S/C21H33NO/c1-2-3-4-10-17-22(18-20-13-6-5-7-14-20)21(23)16-15-19-11-8-9-12-19/h5-7,13-14,19H,2-4,8-12,15-18H2,1H3 |
| InChIKey |
DLGLBHIPVNPVFK-UHFFFAOYSA-N |
| Molecular Weight |
315.501 g/mol |
| SMILES |
C(N(CCCCCC)CC1=CC=CC=C1)(=O)CCC1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931816 |
