| SpectraBase Spectrum ID |
2ppCGN7d9S8 |
| Name |
Cyclohexanecarboxamide, 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 |
315.256214686 u |
| Formula |
C21H33NO |
| InChI |
InChI=1S/C21H33NO/c1-2-3-4-11-17-22(18-16-19-12-7-5-8-13-19)21(23)20-14-9-6-10-15-20/h5,7-8,12-13,20H,2-4,6,9-11,14-18H2,1H3 |
| InChIKey |
FZXZYKZRWWJGFI-UHFFFAOYSA-N |
| Molecular Weight |
315.501 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C1CCCCC1)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95214 |
