| SpectraBase Compound ID | FRiZgovPyMH |
|---|---|
| InChI | InChI=1S/C17H14O6/c1-7-4-8-12(10(18)5-7)16(21)13-9(14(8)19)6-11(22-2)15(20)17(13)23-3/h4-6,18,20H,1-3H3 |
| InChIKey | PRLWQGIPHXIGFR-UHFFFAOYSA-N |
| Mol Weight | 314.29 g/mol |
| Molecular Formula | C17H14O6 |
| Exact Mass | 314.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KIXH1qyVVEO |
|---|---|
| Name | Anthraquinone, 2,8-dihydroxy-1,3-dimethoxy-6-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.079038165 u |
| Formula | C17H14O6 |
| InChI | InChI=1S/C17H14O6/c1-7-4-8-12(10(18)5-7)16(21)13-9(14(8)19)6-11(22-2)15(20)17(13)23-3/h4-6,18,20H,1-3H3 |
| InChIKey | PRLWQGIPHXIGFR-UHFFFAOYSA-N |
| Molecular Weight | 314.293 g/mol |
| SMILES | C=12C(C=3C(=CC(=CC3C(C2=CC(=C(C1OC)O)OC)=O)C)O)=O |