| SpectraBase Compound ID | GhGnIMkRMxa |
|---|---|
| InChI | InChI=1S/C19H16O4/c1-19(2,3)18(22)23-11-8-9-14-15(10-11)17(21)13-7-5-4-6-12(13)16(14)20/h4-10H,1-3H3 |
| InChIKey | VAYJHFGRSXIINQ-UHFFFAOYSA-N |
| Mol Weight | 308.33 g/mol |
| Molecular Formula | C19H16O4 |
| Exact Mass | 308.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K4KxZKxIUut |
|---|---|
| Name | 2-Hydroxyanthraquinone, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.104858991 u |
| Formula | C19H16O4 |
| InChI | InChI=1S/C19H16O4/c1-19(2,3)18(22)23-11-8-9-14-15(10-11)17(21)13-7-5-4-6-12(13)16(14)20/h4-10H,1-3H3 |
| InChIKey | VAYJHFGRSXIINQ-UHFFFAOYSA-N |
| SMILES | C1(OC(C(C)(C)C)=O)=CC2=C(C=C1)C(=O)C=1C(C2=O)=CC=CC1 |