| SpectraBase Compound ID | GyvXd2gW7Ub |
|---|---|
| InChI | InChI=1S/C16H14O7/c1-20-7-4-8(17)12-9(5-7)23-16-11(22-3)6-10(21-2)14(18)13(16)15(12)19/h4-6,17-18H,1-3H3 |
| InChIKey | JKAOZIKMVJGWBK-UHFFFAOYSA-N |
| Mol Weight | 318.28 g/mol |
| Molecular Formula | C16H14O7 |
| Exact Mass | 318.073953 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CA9uvMrXBmG |
|---|---|
| Name | 1,8-Dihydroxy-2,4,6-trimethoxy-xanthone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.073952784 u |
| Formula | C16H14O7 |
| InChI | InChI=1S/C16H14O7/c1-20-7-4-8(17)12-9(5-7)23-16-11(22-3)6-10(21-2)14(18)13(16)15(12)19/h4-6,17-18H,1-3H3 |
| InChIKey | JKAOZIKMVJGWBK-UHFFFAOYSA-N |
| Molecular Weight | 318.281 g/mol |
| SMILES | C1(C=2C(=C(C=C(C2OC=2C=C(C=C(C12)O)OC)OC)OC)O)=O |