| SpectraBase Spectrum ID |
483xhYT4LRO |
| Name |
Cyclopentanecarboxamide, N-benzyl-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.240564621 u |
| Formula |
C20H31NO |
| InChI |
InChI=1S/C20H31NO/c1-2-3-4-5-11-16-21(17-18-12-7-6-8-13-18)20(22)19-14-9-10-15-19/h6-8,12-13,19H,2-5,9-11,14-17H2,1H3 |
| InChIKey |
PMCLYSXHPWLWRY-UHFFFAOYSA-N |
| SMILES |
C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89511 |
