![1-Phenyl-4-[2-quinolyl]-1,3-butanedione](/api/spectrum/2g0E5xjwshZ/structure.png?h=300&w=458 "1-Phenyl-4-[2-quinolyl]-1,3-butanedione")
| SpectraBase Compound ID | F11HSK1q9mi |
|---|---|
| InChI | InChI=1S/C19H15NO2/c21-17(13-19(22)15-7-2-1-3-8-15)12-16-11-10-14-6-4-5-9-18(14)20-16/h1-11H,12-13H2 |
| InChIKey | WQVHFORIYFPOFZ-UHFFFAOYSA-N |
| Mol Weight | 289.33 g/mol |
| Molecular Formula | C19H15NO2 |
| Exact Mass | 289.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2g0E5xjwshZ |
|---|---|
| Name | 1-Phenyl-4-[2-quinolyl]-1,3-butanedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.110278725 u |
| Formula | C19H15NO2 |
| InChI | InChI=1S/C19H15NO2/c21-17(13-19(22)15-7-2-1-3-8-15)12-16-11-10-14-6-4-5-9-18(14)20-16/h1-11H,12-13H2 |
| InChIKey | WQVHFORIYFPOFZ-UHFFFAOYSA-N |
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)CC(CC(C1=CC=CC=C1)=O)=O |