SpectraBase Spectrum ID |
KEW67kdpj3k |
Name |
3-Amino-3',5'-dichloro-2'-hydroxy-p-benzotoluidide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
310.027583032 u |
Formula |
C14H12Cl2N2O2 |
InChI |
InChI=1S/C14H12Cl2N2O2/c1-7-10(15)6-11(13(19)12(7)16)18-14(20)8-3-2-4-9(17)5-8/h2-6,19H,17H2,1H3,(H,18,20) |
InChIKey |
XNBJMXDBXKYSPK-UHFFFAOYSA-N |
SMILES |
OC1=C(C=C(C(=C1Cl)C)Cl)NC(C=1C=CC=C(C1)N)=O |
Spectrum/Structure Validation Score (Raman) |
0.912093 |