| SpectraBase Compound ID | 1haoT44D34F |
|---|---|
| InChI | InChI=1S/C25H26O4/c1-15(2)5-6-16-13-17(7-9-20(16)26)23-14-21(27)18-8-10-22-19(24(18)28-23)11-12-25(3,4)29-22/h5,7-13,23,26H,6,14H2,1-4H3 |
| InChIKey | NEIURIYDQMKXIG-UHFFFAOYSA-N |
| Mol Weight | 390.48 g/mol |
| Molecular Formula | C25H26O4 |
| Exact Mass | 390.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BmQjB4sgp0i |
|---|---|
| Name | Shinflavanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 390.183109313 u |
| Formula | C25H26O4 |
| InChI | InChI=1S/C25H26O4/c1-15(2)5-6-16-13-17(7-9-20(16)26)23-14-21(27)18-8-10-22-19(24(18)28-23)11-12-25(3,4)29-22/h5,7-13,23,26H,6,14H2,1-4H3 |
| InChIKey | NEIURIYDQMKXIG-UHFFFAOYSA-N |
| Molecular Weight | 390.479 g/mol |
| SMILES | C12=C(C=CC(O2)(C)C)C2=C(C=C1)C(CC(O2)C1=CC(=C(C=C1)O)CC=C(C)C)=O |