| SpectraBase Compound ID | I5g83D8m9vp |
|---|---|
| InChI | InChI=1S/C18H14O5/c1-9-14(23-10(2)19)8-13-15(18(9)22-3)17(21)12-7-5-4-6-11(12)16(13)20/h4-8H,1-3H3 |
| InChIKey | OAFGQNMHMMPUMW-UHFFFAOYSA-N |
| Mol Weight | 310.31 g/mol |
| Molecular Formula | C18H14O5 |
| Exact Mass | 310.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1GaPzT4nOs1 |
|---|---|
| Name | 3-Hydroxy-1-methoxy-2-methylanthraquinone, o-acetyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.084123546 u |
| Formula | C18H14O5 |
| InChI | InChI=1S/C18H14O5/c1-9-14(23-10(2)19)8-13-15(18(9)22-3)17(21)12-7-5-4-6-11(12)16(13)20/h4-8H,1-3H3 |
| InChIKey | OAFGQNMHMMPUMW-UHFFFAOYSA-N |
| Molecular Weight | 310.305 g/mol |
| SMILES | C1(OC(=O)C)=CC2=C(C(OC)=C1C)C(=O)C1=C(C2=O)C=CC=C1 |