| SpectraBase Compound ID | 7hVLawTAm2X |
|---|---|
| InChI | InChI=1S/C20H18O4/c1-20(2,3)19(22)24-18-16(21)14-11-7-8-12-15(14)23-17(18)13-9-5-4-6-10-13/h4-12H,1-3H3 |
| InChIKey | NURHOCWQQSKVEG-UHFFFAOYSA-N |
| Mol Weight | 322.36 g/mol |
| Molecular Formula | C20H18O4 |
| Exact Mass | 322.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8w3WwBoFMaz |
|---|---|
| Name | 3-Hydroxyflavone, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.120509056 u |
| Formula | C20H18O4 |
| InChI | InChI=1S/C20H18O4/c1-20(2,3)19(22)24-18-16(21)14-11-7-8-12-15(14)23-17(18)13-9-5-4-6-10-13/h4-12H,1-3H3 |
| InChIKey | NURHOCWQQSKVEG-UHFFFAOYSA-N |
| Molecular Weight | 322.360 g/mol |
| SMILES | C1=C(C=CC=C1)C1=C(OC(C(C)(C)C)=O)C(C2=CC=CC=C2O1)=O |