SpectraBase Spectrum ID |
HrPRxEnfGDB |
Name |
5-Chloro-2-(4-chlorophenoxy)aniline, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.016683996 u |
Formula |
C14H11Cl2NO2 |
InChI |
InChI=1S/C14H11Cl2NO2/c1-9(18)17-13-8-11(16)4-7-14(13)19-12-5-2-10(15)3-6-12/h2-8H,1H3,(H,17,18) |
InChIKey |
GPMTWEDZWVNALP-UHFFFAOYSA-N |
SMILES |
C1(Cl)=CC(=C(C=C1)OC1=CC=C(C=C1)Cl)NC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933958 |