| SpectraBase Compound ID | HgXlEGwrNIk |
|---|---|
| InChI | InChI=1S/C17H16O4/c1-11-3-6-14(18)13(9-11)15(19)7-4-12-5-8-16(20)17(10-12)21-2/h3-10,18,20H,1-2H3/b7-4+ |
| InChIKey | WNMAPNHXZFEFDI-QPJJXVBHSA-N |
| Mol Weight | 284.31 g/mol |
| Molecular Formula | C17H16O4 |
| Exact Mass | 284.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2qUwmR7yqrx |
|---|---|
| Name | 4,2'-Dihydroxy-3-methoxy-5'-methylchalcone (isomer 2) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.104858991 u |
| Formula | C17H16O4 |
| InChI | InChI=1S/C17H16O4/c1-11-3-6-14(18)13(9-11)15(19)7-4-12-5-8-16(20)17(10-12)21-2/h3-10,18,20H,1-2H3/b7-4+ |
| InChIKey | WNMAPNHXZFEFDI-QPJJXVBHSA-N |
| SMILES | C1(=C(C=CC(=C1)C)O)C(\C=C\C=1C=CC(O)=C(C1)OC)=O |