| SpectraBase Spectrum ID |
77unGMTSH6R |
| Name |
3-Pyridinamine, N-[(3-nitrophenyl)methylene]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.069476540 u |
| Formula |
C12H9N3O2 |
| InChI |
InChI=1S/C12H9N3O2/c16-15(17)12-5-1-3-10(7-12)8-14-11-4-2-6-13-9-11/h1-9H/b14-8+ |
| InChIKey |
WGHILNQBASRSIY-RIYZIHGNSA-N |
| Molecular Weight |
227.223 g/mol |
| SMILES |
C1=NC=CC=C1\N=C\C1=CC(N(=O)=O)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870014 |
![3-Pyridinamine, N-[(3-nitrophenyl)methylene]-](/api/spectrum/77unGMTSH6R/structure.png?h=300&w=458 "3-Pyridinamine, N-[(3-nitrophenyl)methylene]-")
