| SpectraBase Spectrum ID |
4DEW8ZIx8dN |
| Name |
Aniline, N-methyl-N-(2-nitrovinyl)-; benzenamine, N-methyl-N-(2-nitroethenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
178.074227568 u |
| Formula |
C9H10N2O2 |
| InChI |
InChI=1S/C9H10N2O2/c1-10(7-8-11(12)13)9-5-3-2-4-6-9/h2-8H,1H3/b8-7+ |
| InChIKey |
RUTWDVHNQBLUFO-BQYQJAHWSA-N |
| Molecular Weight |
178.191 g/mol |
| SMILES |
C1(=CC=CC=C1)N(\C=C\[N+]([O-])=O)C |
| Spectrum/Structure Validation Score (Raman) |
0.90226 |