SpectraBase Spectrum ID |
J2dtAQwYenQ |
Name |
5H-Dibenz[B,F]azepine, 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 |
224.094963013 u |
Formula |
C14H12N2O |
InChI |
InChI=1S/C14H12N2O/c17-15-16-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16/h1-8H,9-10H2 |
InChIKey |
AVXDYTPASFOWQY-UHFFFAOYSA-N |
Molecular Weight |
224.263 g/mol |
SMILES |
C1=2N(N=O)C3=C(CCC2C=CC=C1)C=CC=C3 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887082 |