| SpectraBase Spectrum ID |
6OkCrxx8pZd |
| Name |
Cyclohexanecarboxamide, N-(2-phenylethyl)-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
455.412715330 u |
| Formula |
C31H53NO |
| InChI |
InChI=1S/C31H53NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-27-32(28-26-29-22-17-15-18-23-29)31(33)30-24-19-16-20-25-30/h15,17-18,22-23,30H,2-14,16,19-21,24-28H2,1H3 |
| InChIKey |
BHVSQRPYQDBJOJ-UHFFFAOYSA-N |
| Molecular Weight |
455.771 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C1CCCCC1)CCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896823 |
