![1-[6-(2-Pyridyl)pyridyl]-2-(2-pyridyl)ethanone](/api/spectrum/A9UjJb8LJJf/structure.png?h=300&w=458 "1-[6-(2-Pyridyl)pyridyl]-2-(2-pyridyl)ethanone")
| SpectraBase Compound ID | FPIuKQ9DEQG |
|---|---|
| InChI | InChI=1S/C17H13N3O/c21-17(12-13-6-1-3-10-18-13)16-9-5-8-15(20-16)14-7-2-4-11-19-14/h1-11H,12H2 |
| InChIKey | XMGBVAGTTCMJMT-UHFFFAOYSA-N |
| Mol Weight | 275.31 g/mol |
| Molecular Formula | C17H13N3O |
| Exact Mass | 275.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A9UjJb8LJJf |
|---|---|
| Name | 1-[6-(2-Pyridyl)pyridyl]-2-(2-pyridyl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.105862050 u |
| Formula | C17H13N3O |
| InChI | InChI=1S/C17H13N3O/c21-17(12-13-6-1-3-10-18-13)16-9-5-8-15(20-16)14-7-2-4-11-19-14/h1-11H,12H2 |
| InChIKey | XMGBVAGTTCMJMT-UHFFFAOYSA-N |
| SMILES | C(CC=1C=CC=CN1)(C=1C=CC=C(N1)C=1C=CC=CN1)=O |