| SpectraBase Compound ID | IILLnXegTu9 |
|---|---|
| InChI | InChI=1S/C18H14O5/c1-11(19)22-15-9-8-14-17(18(15)21-2)13(20)10-16(23-14)12-6-4-3-5-7-12/h3-10H,1-2H3 |
| InChIKey | WPCFHVAUIJXUAD-UHFFFAOYSA-N |
| Mol Weight | 310.31 g/mol |
| Molecular Formula | C18H14O5 |
| Exact Mass | 310.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68XNAObuYLG |
|---|---|
| Name | 6-Hydroxy-5-methoxyflavone, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.084123546 u |
| Formula | C18H14O5 |
| InChI | InChI=1S/C18H14O5/c1-11(19)22-15-9-8-14-17(18(15)21-2)13(20)10-16(23-14)12-6-4-3-5-7-12/h3-10H,1-2H3 |
| InChIKey | WPCFHVAUIJXUAD-UHFFFAOYSA-N |
| Molecular Weight | 310.305 g/mol |
| SMILES | C1(=CC(=O)C2=C(C(=CC=C2O1)OC(C)=O)OC)C1=CC=CC=C1 |