| SpectraBase Spectrum ID |
D0arwRvkvPU |
| Name |
Benzamide, 4-chloro-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 |
343.170292160 u |
| Formula |
C21H26ClNO |
| InChI |
InChI=1S/C21H26ClNO/c1-2-3-4-8-16-23(17-15-18-9-6-5-7-10-18)21(24)19-11-13-20(22)14-12-19/h5-7,9-14H,2-4,8,15-17H2,1H3 |
| InChIKey |
OLTWGXAVPMZGFD-UHFFFAOYSA-N |
| Molecular Weight |
343.898 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)Cl)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921892 |
