| SpectraBase Compound ID | IjDMbNFsxDf |
|---|---|
| InChI | InChI=1S/C21H30O6/c1-10(2)7-11(22)15-16(24)20-9-13(19(5,6)26)18(3,4)12(20)8-14(23)21(20,27)17(15)25/h10,12-13,25-27H,7-9H2,1-6H3 |
| InChIKey | STOCQYJLLHLJHU-UHFFFAOYSA-N |
| Mol Weight | 378.47 g/mol |
| Molecular Formula | C21H30O6 |
| Exact Mass | 378.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1iKqf6ec9E |
|---|---|
| Name | TRICYClOOXYISOHUMULONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O6 |
| InChI | InChI=1S/C21H30O6/c1-10(2)7-11(22)15-16(24)20-9-13(19(5,6)26)18(3,4)12(20)8-14(23)21(20,27)17(15)25/h10,12-13,25-27H,7-9H2,1-6H3 |
| InChIKey | STOCQYJLLHLJHU-UHFFFAOYSA-N |
| Literature Reference Author | K.WAERTGEN,M.WICHTL |
| Literature Reference Citation | PLANTA.MED.,57,498(1991) |
| Literature Reference DOI | 10.1055/s-2006-960183 |
| Molecular Weight | 378.466 g/mol |
| Solvent | CD3OD |
| Source File Reference | UIAP217 |