SpectraBase Spectrum ID |
DsrZyojmVIV |
Name |
Benzenamine, N-[(4-methylphenyl)methylene]-4-nitro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
240.089877632 u |
Formula |
C14H12N2O2 |
InChI |
InChI=1S/C14H12N2O2/c1-11-2-4-12(5-3-11)10-15-13-6-8-14(9-7-13)16(17)18/h2-10H,1H3/b15-10+ |
InChIKey |
PZHYCUFBBDDVKW-XNTDXEJSSA-N |
Molecular Weight |
240.262 g/mol |
SMILES |
CC1=CC=C(\C=N\C2=CC=C(N(=O)=O)C=C2)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80286 |