| SpectraBase Compound ID | LyQFge6PNs5 |
|---|---|
| InChI | InChI=1S/C15H14O6/c1-15(21)4-6-10(9(18)5-15)14(20)12-8(17)3-2-7(16)11(12)13(6)19/h2-3,9,16-18,21H,4-5H2,1H3 |
| InChIKey | ZWGAXAQJDYJGGO-UHFFFAOYSA-N |
| Mol Weight | 290.27 g/mol |
| Molecular Formula | C15H14O6 |
| Exact Mass | 290.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6yrXefCRknU |
|---|---|
| Name | (1rs,3sr)-1,3,5,8,-Tetrahydroxy-3-methyl-1,2,3,4,-tetrahydro-9,10-anthraquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.079038165 u |
| Formula | C15H14O6 |
| InChI | InChI=1S/C15H14O6/c1-15(21)4-6-10(9(18)5-15)14(20)12-8(17)3-2-7(16)11(12)13(6)19/h2-3,9,16-18,21H,4-5H2,1H3 |
| InChIKey | ZWGAXAQJDYJGGO-UHFFFAOYSA-N |
| SMILES | C12=C(C(=O)C=3C(C2=O)=C(C=CC3O)O)CC(CC1O)(O)C |