| SpectraBase Spectrum ID |
35BZOK0p4sJ |
| Name |
N-(5-Chloranyl-2-nitro-phenyl)ethanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.014519790 u |
| Formula |
C8H7ClN2O3 |
| InChI |
InChI=1S/C8H7ClN2O3/c1-5(12)10-7-4-6(9)2-3-8(7)11(13)14/h2-4H,1H3,(H,10,12) |
| InChIKey |
YWANGSCDWBUSBK-UHFFFAOYSA-N |
| Molecular Weight |
214.608 g/mol |
| SMILES |
CC(NC=1C(N(=O)=O)=CC=C(Cl)C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966198 |
