| SpectraBase Compound ID | GLFX0mN3Gu3 |
|---|---|
| InChI | InChI=1S/C18H14O5/c1-11(19)23-17-9-15-13(8-16(17)21-2)18(20)14(10-22-15)12-6-4-3-5-7-12/h3-10H,1-2H3 |
| InChIKey | QIGZEMSYJWBWHH-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 | 9Vd78LBPAsn |
|---|---|
| Name | 7-Hydroxy-6-methoxyisoflavone, 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)23-17-9-15-13(8-16(17)21-2)18(20)14(10-22-15)12-6-4-3-5-7-12/h3-10H,1-2H3 |
| InChIKey | QIGZEMSYJWBWHH-UHFFFAOYSA-N |
| Molecular Weight | 310.305 g/mol |
| SMILES | C1(=CC=CC=C1)C=1C(C2=CC(=C(C=C2OC1)OC(C)=O)OC)=O |