| SpectraBase Compound ID | 7JWC4dkLqJP |
|---|---|
| InChI | InChI=1S/C20H20O3/c1-14(2)20(22)23-19-7-5-4-6-17(19)18(21)13-12-16-10-8-15(3)9-11-16/h4-14H,1-3H3/b13-12+ |
| InChIKey | GBULLXQCVYEJAL-OUKQBFOZSA-N |
| Mol Weight | 308.38 g/mol |
| Molecular Formula | C20H20O3 |
| Exact Mass | 308.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5tvPi3Izddd |
|---|---|
| Name | 2'-Hydroxy-4-methylchalcone, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.141244501 u |
| Formula | C20H20O3 |
| InChI | InChI=1S/C20H20O3/c1-14(2)20(22)23-19-7-5-4-6-17(19)18(21)13-12-16-10-8-15(3)9-11-16/h4-14H,1-3H3/b13-12+ |
| InChIKey | GBULLXQCVYEJAL-OUKQBFOZSA-N |
| Molecular Weight | 308.377 g/mol |
| SMILES | C1(=CC=CC=C1OC(C(C)C)=O)C(\C=C\C1=CC=C(C=C1)C)=O |