| SpectraBase Compound ID | DU7JaBxCXtZ |
|---|---|
| InChI | InChI=1S/C19H16O4/c1-12(2)19(21)23-16-10-6-9-15-18(16)14(20)11-17(22-15)13-7-4-3-5-8-13/h3-12H,1-2H3 |
| InChIKey | RWKUZCNZEFJOTF-UHFFFAOYSA-N |
| Mol Weight | 308.33 g/mol |
| Molecular Formula | C19H16O4 |
| Exact Mass | 308.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BfldngngJUo |
|---|---|
| Name | 5-Hydroxyflavone, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.104858991 u |
| Formula | C19H16O4 |
| InChI | InChI=1S/C19H16O4/c1-12(2)19(21)23-16-10-6-9-15-18(16)14(20)11-17(22-15)13-7-4-3-5-8-13/h3-12H,1-2H3 |
| InChIKey | RWKUZCNZEFJOTF-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC=C1)C1=CC(C2=C(C=CC=C2O1)OC(C(C)C)=O)=O |