| SpectraBase Spectrum ID |
GWkW2msoP2H |
| Name |
3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.271864750 u |
| Formula |
C22H35NO |
| InChI |
InChI=1S/C22H35NO/c1-2-3-4-10-18-23(19-17-21-11-6-5-7-12-21)22(24)16-15-20-13-8-9-14-20/h5-7,11-12,20H,2-4,8-10,13-19H2,1H3 |
| InChIKey |
UNUWOAPTMFHKGL-UHFFFAOYSA-N |
| Molecular Weight |
329.528 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)CCC1CCCC1)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80467 |
