| SpectraBase Compound ID | 2so4cdlG6Cl |
|---|---|
| InChI | InChI=1S/C15H12N2O3/c1-11-2-6-13(10-16-11)15(18)9-5-12-3-7-14(8-4-12)17(19)20/h2-10H,1H3/b9-5+ |
| InChIKey | IBLDIWRYVIOXLB-WEVVVXLNSA-N |
| Mol Weight | 268.27 g/mol |
| Molecular Formula | C15H12N2O3 |
| Exact Mass | 268.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FDJBwPEEZAM |
|---|---|
| Name | 1-(6-Methyl-3-pyridyl)-3-(p-nitrophenyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.084792251 u |
| Formula | C15H12N2O3 |
| InChI | InChI=1S/C15H12N2O3/c1-11-2-6-13(10-16-11)15(18)9-5-12-3-7-14(8-4-12)17(19)20/h2-10H,1H3/b9-5+ |
| InChIKey | IBLDIWRYVIOXLB-WEVVVXLNSA-N |
| SMILES | C1(=CN=C(C=C1)C)C(\C=C\C1=CC=C(N(=O)=O)C=C1)=O |