SpectraBase Spectrum ID |
JhmaekQi9ob |
Name |
Methanone, (2-amino-3,6-dichloro-5-hydroxyphenyl)phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.001033932 u |
Formula |
C13H9Cl2NO2 |
InChI |
InChI=1S/C13H9Cl2NO2/c14-8-6-9(17)11(15)10(12(8)16)13(18)7-4-2-1-3-5-7/h1-6,17H,16H2 |
InChIKey |
MHFJIRWSJABIFH-UHFFFAOYSA-N |
Molecular Weight |
282.126 g/mol |
SMILES |
C=1(C(=O)C=2C=CC=CC2)C(=C(Cl)C=C(C1Cl)O)N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89128 |