| SpectraBase Compound ID | DR4pmQI29YD |
|---|---|
| InChI | InChI=1S/C16H12O5/c1-20-11-7-10(17)12-13(16(11)21-2)15(19)9-6-4-3-5-8(9)14(12)18/h3-7,17H,1-2H3 |
| InChIKey | YAUKMDFVHQLJDJ-UHFFFAOYSA-N |
| Mol Weight | 284.27 g/mol |
| Molecular Formula | C16H12O5 |
| Exact Mass | 284.068473 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ANFTFi19XeY |
|---|---|
| Name | 4-Hydroxy-1,2-dimethoxyanthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.068473481 u |
| Formula | C16H12O5 |
| InChI | InChI=1S/C16H12O5/c1-20-11-7-10(17)12-13(16(11)21-2)15(19)9-6-4-3-5-8(9)14(12)18/h3-7,17H,1-2H3 |
| InChIKey | YAUKMDFVHQLJDJ-UHFFFAOYSA-N |
| SMILES | C=12C(C(=O)C3=C(C2=O)C=CC=C3)=C(OC)C(=CC1O)OC |