| SpectraBase Spectrum ID |
H53w1c8omAp |
| Name |
2-Chloro-N-[1-(3-chlorophenyl)ethyl]acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.021769377 u |
| Formula |
C10H11Cl2NO |
| InChI |
InChI=1S/C10H11Cl2NO/c1-7(13-10(14)6-11)8-3-2-4-9(12)5-8/h2-5,7H,6H2,1H3,(H,13,14) |
| InChIKey |
IPGDMBWEYHBLRL-UHFFFAOYSA-N |
| Molecular Weight |
232.110 g/mol |
| SMILES |
C(Cl)C(=O)NC(C)C1=CC(=CC=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959882 |