| SpectraBase Compound ID | HKKJRozxJTm |
|---|---|
| InChI | InChI=1S/C13H10N2O2/c16-15(17)13-7-2-1-5-11(13)8-9-12-6-3-4-10-14-12/h1-10H/b9-8+ |
| InChIKey | YADNATDOWRSAOC-CMDGGOBGSA-N |
| Mol Weight | 226.23 g/mol |
| Molecular Formula | C13H10N2O2 |
| Exact Mass | 226.074228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Pv3cYdaWvq |
|---|---|
| Name | Pyridine, 2-(2-(2-nitrophenyl)ethenyl)-, trans |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.074227568 u |
| Formula | C13H10N2O2 |
| InChI | InChI=1S/C13H10N2O2/c16-15(17)13-7-2-1-5-11(13)8-9-12-6-3-4-10-14-12/h1-10H/b9-8+ |
| InChIKey | YADNATDOWRSAOC-CMDGGOBGSA-N |
| Molecular Weight | 226.235 g/mol |
| SMILES | C1(N(=O)=O)=CC=CC=C1\C=C\C1=CC=CC=N1 |