| SpectraBase Spectrum ID |
93woizDxpL1 |
| Name |
Benzamide, 2-chloro-N-benzyl-N-heptyl- |
| 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/c1-2-3-4-5-11-16-23(17-18-12-7-6-8-13-18)21(24)19-14-9-10-15-20(19)22/h6-10,12-15H,2-5,11,16-17H2,1H3 |
| InChIKey |
WQWUOJWCITWECJ-UHFFFAOYSA-N |
| Molecular Weight |
343.898 g/mol |
| SMILES |
C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C=1C(Cl)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912417 |
