SpectraBase Spectrum ID |
IUt5Hpn9FAq |
Name |
Acetamide, N-(2-chloro-4-nitrophenyl)- |
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)10-8-3-2-6(11(13)14)4-7(8)9/h2-4H,1H3,(H,10,12) |
InChIKey |
OAFVRHMRZVHVDQ-UHFFFAOYSA-N |
Molecular Weight |
214.608 g/mol |
SMILES |
C1(NC(C)=O)=C(C=C(C=C1)N(=O)=O)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983676 |