| SpectraBase Compound ID | AqMQI1OBEUk |
|---|---|
| InChI | InChI=1S/C20H20O4/c1-14(2)20(22)24-19-16(10-7-11-18(19)23-3)12-13-17(21)15-8-5-4-6-9-15/h4-14H,1-3H3/b13-12+ |
| InChIKey | NSJIKPNFSPVXOQ-OUKQBFOZSA-N |
| Mol Weight | 324.38 g/mol |
| Molecular Formula | C20H20O4 |
| Exact Mass | 324.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DCNrr1EnsYw |
|---|---|
| Name | 2-Hydroxy-3-methoxychalcone, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.136159120 u |
| Formula | C20H20O4 |
| InChI | InChI=1S/C20H20O4/c1-14(2)20(22)24-19-16(10-7-11-18(19)23-3)12-13-17(21)15-8-5-4-6-9-15/h4-14H,1-3H3/b13-12+ |
| InChIKey | NSJIKPNFSPVXOQ-OUKQBFOZSA-N |
| Molecular Weight | 324.376 g/mol |
| SMILES | C1(=CC=CC=C1)C(\C=C\C1=C(C(=CC=C1)OC)OC(C(C)C)=O)=O |