| SpectraBase Compound ID | Ksio1TCFeov |
|---|---|
| InChI | InChI=1S/C20H20O3/c1-20(2,3)13-22-19-17(21)15-11-7-8-12-16(15)23-18(19)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3 |
| InChIKey | OFJANWJDPWPROK-UHFFFAOYSA-N |
| Mol Weight | 308.38 g/mol |
| Molecular Formula | C20H20O3 |
| Exact Mass | 308.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3FDQyaAaDJ8 |
|---|---|
| Name | 3-(Neopentyl)oxyflavone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.141244501 u |
| Formula | C20H20O3 |
| InChI | InChI=1S/C20H20O3/c1-20(2,3)13-22-19-17(21)15-11-7-8-12-16(15)23-18(19)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3 |
| InChIKey | OFJANWJDPWPROK-UHFFFAOYSA-N |
| Molecular Weight | 308.377 g/mol |
| SMILES | C1=CC=CC=C1C1=C(OCC(C)(C)C)C(C2=C(C=CC=C2)O1)=O |