| SpectraBase Compound ID | JBsqWKb2vcn |
|---|---|
| InChI | InChI=1S/C18H18O4/c1-12-4-7-14(8-5-12)15(19)9-6-13-10-16(21-2)18(20)17(11-13)22-3/h4-11,20H,1-3H3/b9-6+ |
| InChIKey | PTQZPYCAVDTMQZ-RMKNXTFCSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C18H18O4 |
| Exact Mass | 298.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BC41v3GsZx4 |
|---|---|
| Name | 3-(4-Hydroxy-3,5-dimethoxyphenyl)-1-(4-methylphenyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.120509056 u |
| Formula | C18H18O4 |
| InChI | InChI=1S/C18H18O4/c1-12-4-7-14(8-5-12)15(19)9-6-13-10-16(21-2)18(20)17(11-13)22-3/h4-11,20H,1-3H3/b9-6+ |
| InChIKey | PTQZPYCAVDTMQZ-RMKNXTFCSA-N |
| SMILES | C1(=C(C=C(\C=C\C(C2=CC=C(C=C2)C)=O)C=C1OC)OC)O |