| SpectraBase Compound ID | FhOBhutgaJO |
|---|---|
| InChI | InChI=1S/C17H16O5/c1-21-14-9-12(8-13(18)10-14)15(19)5-3-11-4-6-16(20)17(7-11)22-2/h3-10,18,20H,1-2H3/b5-3+ |
| InChIKey | AQLOAHKCWBCXIA-HWKANZROSA-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 | EDbADYcSn4b |
|---|---|
| Name | (2E)-1-(3-Hydroxy-5-methoxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-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/c1-21-14-9-12(8-13(18)10-14)15(19)5-3-11-4-6-16(20)17(7-11)22-2/h3-10,18,20H,1-2H3/b5-3+ |
| InChIKey | AQLOAHKCWBCXIA-HWKANZROSA-N |
| SMILES | C=1(C(\C=C\C=2C=C(OC)C(=CC2)O)=O)C=C(O)C=C(C1)OC |