SpectraBase Spectrum ID |
KMUkCRcd394 |
Name |
Benzenamine, N-[(4-nitrophenyl)methylene]-2-[1-propenyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.105527697 u |
Formula |
C16H14N2O2 |
InChI |
InChI=1S/C16H14N2O2/c1-2-5-14-6-3-4-7-16(14)17-12-13-8-10-15(11-9-13)18(19)20/h2-12H,1H3/b5-2+,17-12+ |
InChIKey |
PIRJOYSWISKUEX-GJGFIMSGSA-N |
Molecular Weight |
266.300 g/mol |
SMILES |
C1=CC=CC(=C1\N=C\C1=CC=C(C=C1)N(=O)=O)\C=C\C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856409 |