| SpectraBase Compound ID | L5i6yw4pkGV |
|---|---|
| InChI | InChI=1S/C17H16O5/c1-21-16-8-4-11(9-17(16)22-2)3-7-14(19)13-6-5-12(18)10-15(13)20/h3-10,18,20H,1-2H3/b7-3+ |
| InChIKey | ZMMIEHPFMMRMMN-XVNBXDOJSA-N |
| Mol Weight | 300.31 g/mol |
| Molecular Formula | C17H16O5 |
| Exact Mass | 300.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JxdOiA5uQ1t |
|---|---|
| Name | 1-(2, 4-Dihydroxy-phenyl)-3-(3,4-dimethoxyphenyl)-propene-L-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.099773610 u |
| Formula | C17H16O5 |
| InChI | InChI=1S/C17H16O5/c1-21-16-8-4-11(9-17(16)22-2)3-7-14(19)13-6-5-12(18)10-15(13)20/h3-10,18,20H,1-2H3/b7-3+ |
| InChIKey | ZMMIEHPFMMRMMN-XVNBXDOJSA-N |
| SMILES | C=1(C(=CC(=CC1)O)O)C(\C=C\C1=CC(OC)=C(C=C1)OC)=O |