SpectraBase Spectrum ID |
G6JY8Q0oSnP |
Name |
p-Chloro-N-(o-chlorobenzylidene)aniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.011204694 u |
Formula |
C13H9Cl2N |
InChI |
InChI=1S/C13H9Cl2N/c14-11-5-7-12(8-6-11)16-9-10-3-1-2-4-13(10)15/h1-9H/b16-9+ |
InChIKey |
PRMCHDFWRMALCQ-CXUHLZMHSA-N |
Molecular Weight |
250.128 g/mol |
SMILES |
C=1C(=CC=C(C1)Cl)\N=C\C=1C(=CC=CC1)Cl |
Spectrum/Structure Validation Score (Raman) |
0.972095 |