| SpectraBase Compound ID | 3BHvCzFESmG |
|---|---|
| InChI | InChI=1S/C17H14O2/c1-11-8-12(2)17-14(9-11)15(18)10-16(19-17)13-6-4-3-5-7-13/h3-10H,1-2H3 |
| InChIKey | SIXVURZOAATBIB-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C17H14O2 |
| Exact Mass | 250.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IYKt8jGNpSO |
|---|---|
| Name | 6,8-Dimethyl-2-phenyl-1-benzopyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.099379689 u |
| Formula | C17H14O2 |
| InChI | InChI=1S/C17H14O2/c1-11-8-12(2)17-14(9-11)15(18)10-16(19-17)13-6-4-3-5-7-13/h3-10H,1-2H3 |
| InChIKey | SIXVURZOAATBIB-UHFFFAOYSA-N |
| Molecular Weight | 250.297 g/mol |
| SMILES | C1=2OC(=CC(C2C=C(C=C1C)C)=O)C1=CC=CC=C1 |