| SpectraBase Compound ID | 5munHdV0UiU |
|---|---|
| InChI | InChI=1S/C15H10O4/c1-9(16)18-10-6-7-12-14(8-10)19-13-5-3-2-4-11(13)15(12)17/h2-8H,1H3 |
| InChIKey | SYXNROCBWJOOJM-UHFFFAOYSA-N |
| Mol Weight | 254.24 g/mol |
| Molecular Formula | C15H10O4 |
| Exact Mass | 254.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2WfgIjXbqYs |
|---|---|
| Name | 3-Hydroxyxanthone, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.057908798 u |
| Formula | C15H10O4 |
| InChI | InChI=1S/C15H10O4/c1-9(16)18-10-6-7-12-14(8-10)19-13-5-3-2-4-11(13)15(12)17/h2-8H,1H3 |
| InChIKey | SYXNROCBWJOOJM-UHFFFAOYSA-N |
| Molecular Weight | 254.241 g/mol |
| SMILES | C1=2OC3=C(C(C2C=CC(=C1)OC(C)=O)=O)C=CC=C3 |