| SpectraBase Compound ID | 6OnLpRrAzDy |
|---|---|
| InChI | InChI=1S/C17H14O4/c1-10(2)17(19)20-11-7-8-13-15(9-11)21-14-6-4-3-5-12(14)16(13)18/h3-10H,1-2H3 |
| InChIKey | HGWCMLNGJVWKKG-UHFFFAOYSA-N |
| Mol Weight | 282.3 g/mol |
| Molecular Formula | C17H14O4 |
| Exact Mass | 282.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HTcoSre1VsT |
|---|---|
| Name | 3-Hydroxyxanthone, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.089208927 u |
| Formula | C17H14O4 |
| InChI | InChI=1S/C17H14O4/c1-10(2)17(19)20-11-7-8-13-15(9-11)21-14-6-4-3-5-12(14)16(13)18/h3-10H,1-2H3 |
| InChIKey | HGWCMLNGJVWKKG-UHFFFAOYSA-N |
| SMILES | C1=2OC3=C(C(C2C=CC(=C1)OC(C(C)C)=O)=O)C=CC=C3 |