| SpectraBase Compound ID | 6yp7fsAi38F |
|---|---|
| InChI | InChI=1S/C20H20O6/c1-13(21)26-19-16(10-12-18(24-3)20(19)25-4)17(22)11-7-14-5-8-15(23-2)9-6-14/h5-12H,1-4H3/b11-7+ |
| InChIKey | DLBJKGCXXNYKIC-YRNVUSSQSA-N |
| Mol Weight | 356.37 g/mol |
| Molecular Formula | C20H20O6 |
| Exact Mass | 356.125988 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8iDzdiV2o1v |
|---|---|
| Name | 2'-(Acetyl)oxy-3',4',4-trimethoxychalcone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.125988358 u |
| Formula | C20H20O6 |
| InChI | InChI=1S/C20H20O6/c1-13(21)26-19-16(10-12-18(24-3)20(19)25-4)17(22)11-7-14-5-8-15(23-2)9-6-14/h5-12H,1-4H3/b11-7+ |
| InChIKey | DLBJKGCXXNYKIC-YRNVUSSQSA-N |
| Molecular Weight | 356.374 g/mol |
| SMILES | C1(=CC=C(C(=C1OC(C)=O)OC)OC)C(\C=C\C1=CC=C(C=C1)OC)=O |