| SpectraBase Spectrum ID |
Gjb519IeAM0 |
| Name |
2-Propenenitrile, 3-(4-aminophenyl)-2-(4-nitrophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.085126604 u |
| Formula |
C15H11N3O2 |
| InChI |
InChI=1S/C15H11N3O2/c16-10-13(9-11-1-5-14(17)6-2-11)12-3-7-15(8-4-12)18(19)20/h1-9H,17H2/b13-9+ |
| InChIKey |
VIDMLKWZJGGPCF-UKTHLTGXSA-N |
| SMILES |
C1=C(C=CC(=C1)N)\C=C\(C1=CC=C(N(=O)=O)C=C1)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872058 |
