| SpectraBase Spectrum ID |
4p7kHrUqITy |
| Name |
Benzamide, 4-butyl-N-(2-phenylethyl)-N-octyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.303164879 u |
| Formula |
C27H39NO |
| InChI |
InChI=1S/C27H39NO/c1-3-5-7-8-9-13-22-28(23-21-24-15-11-10-12-16-24)27(29)26-19-17-25(18-20-26)14-6-4-2/h10-12,15-20H,3-9,13-14,21-23H2,1-2H3 |
| InChIKey |
KFKVZNGSGDCLMP-UHFFFAOYSA-N |
| Molecular Weight |
393.615 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)CCCC)CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934336 |
