SpectraBase Spectrum ID |
rBn5OyJXY4 |
Name |
Chromone, 3-(2,3-dichlorophenyliminomethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.001033932 u |
Formula |
C16H9Cl2NO2 |
InChI |
InChI=1S/C16H9Cl2NO2/c17-12-5-3-6-13(15(12)18)19-8-10-9-21-14-7-2-1-4-11(14)16(10)20/h1-9H/b19-8+ |
InChIKey |
YJGXZAXQRYZYGC-UFWORHAWSA-N |
Molecular Weight |
318.159 g/mol |
SMILES |
C=1(C(C2=C(OC1)C=CC=C2)=O)\C=N\C1=C(C(Cl)=CC=C1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934814 |