| SpectraBase Compound ID | 8fgeIbFfD7U |
|---|---|
| InChI | InChI=1S/C20H20O7/c1-11-6-16(24-13(3)21)10-17(7-11)27-19-9-12(2)8-18(25-14(4)22)20(19)26-15(5)23/h6-10H,1-5H3 |
| InChIKey | WXNZOWKJIFKLMC-UHFFFAOYSA-N |
| Mol Weight | 372.37 g/mol |
| Molecular Formula | C20H20O7 |
| Exact Mass | 372.120903 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | At1ALfcKrZB |
|---|---|
| Name | Cordyol C, 3ac derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.120902977 u |
| Formula | C20H20O7 |
| InChI | InChI=1S/C20H20O7/c1-11-6-16(24-13(3)21)10-17(7-11)27-19-9-12(2)8-18(25-14(4)22)20(19)26-15(5)23/h6-10H,1-5H3 |
| InChIKey | WXNZOWKJIFKLMC-UHFFFAOYSA-N |
| Molecular Weight | 372.373 g/mol |
| SMILES | C1(=C(C(=CC(=C1)C)OC1=CC(=CC(=C1)C)OC(C)=O)OC(C)=O)OC(C)=O |