| SpectraBase Compound ID | Ck2WCrCeD2E |
|---|---|
| InChI | InChI=1S/C17H18O5/c1-10(11-6-13(21-2)9-14(7-11)22-3)17(20)15-5-4-12(18)8-16(15)19/h4-10,18-19H,1-3H3 |
| InChIKey | TURHNAJJDDIVGC-UHFFFAOYSA-N |
| Mol Weight | 302.33 g/mol |
| Molecular Formula | C17H18O5 |
| Exact Mass | 302.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | oUXwxm5bb7 |
|---|---|
| Name | 1-(2,4-Dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.115423675 u |
| Formula | C17H18O5 |
| InChI | InChI=1S/C17H18O5/c1-10(11-6-13(21-2)9-14(7-11)22-3)17(20)15-5-4-12(18)8-16(15)19/h4-10,18-19H,1-3H3 |
| InChIKey | TURHNAJJDDIVGC-UHFFFAOYSA-N |
| SMILES | C(C(C)C1=CC(=CC(=C1)OC)OC)(=O)C=1C(O)=CC(O)=CC1 |