SpectraBase Spectrum ID |
CIVLK8jzij |
Name |
5H-Dibenz[B,F]azepine, 3,7-dichloro-10,11-dihydro-5-nitroso- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.017018349 u |
Formula |
C14H10Cl2N2O |
InChI |
InChI=1S/C14H10Cl2N2O/c15-11-5-3-9-1-2-10-4-6-12(16)8-14(10)18(17-19)13(9)7-11/h3-8H,1-2H2 |
InChIKey |
RWYHNZVFRDRIJI-UHFFFAOYSA-N |
Molecular Weight |
293.153 g/mol |
SMILES |
C1(Cl)=CC=2N(C3=C(CCC2C=C1)C=CC(Cl)=C3)N=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903575 |