| SpectraBase Compound ID | IQ5zIQmzUNU |
|---|---|
| InChI | InChI=1S/C14H8O5/c15-6-1-2-7-8(5-6)14(19)12-10(17)4-3-9(16)11(12)13(7)18/h1-5,15-17H |
| InChIKey | FDXKFCSGFMVEEG-UHFFFAOYSA-N |
| Mol Weight | 256.21 g/mol |
| Molecular Formula | C14H8O5 |
| Exact Mass | 256.037173 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KU4ZPtm0PSM |
|---|---|
| Name | 1,4,6-Trihydroxy-9,10-anthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.037173353 u |
| Formula | C14H8O5 |
| InChI | InChI=1S/C14H8O5/c15-6-1-2-7-8(5-6)14(19)12-10(17)4-3-9(16)11(12)13(7)18/h1-5,15-17H |
| InChIKey | FDXKFCSGFMVEEG-UHFFFAOYSA-N |
| Molecular Weight | 256.213 g/mol |
| SMILES | C=1(C=CC(=C2C(C=3C=C(C=CC3C(C12)=O)O)=O)O)O |