| SpectraBase Compound ID | 55wSOP45SFr |
|---|---|
| InChI | InChI=1S/C20H30O6/c1-11-14(22)15(23)16-18(2,3)7-5-8-19(16,4)20(11,25)9-6-12-10-13(21)26-17(12)24/h10-11,14,16-17,22,24-25H,5-9H2,1-4H3/t11-,14-,16+,17?,19+,20-/m1/s1 |
| InChIKey | ORLJFXGZZYWOIF-VOYILKFQSA-N |
| Mol Weight | 366.45 g/mol |
| Molecular Formula | C20H30O6 |
| Exact Mass | 366.204239 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GXH93nF3H1H |
|---|---|
| Name | Sibiricinone A |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O6 |
| InChI | InChI=1S/C20H30O6/c1-11-14(22)15(23)16-18(2,3)7-5-8-19(16,4)20(11,25)9-6-12-10-13(21)26-17(12)24/h10-11,14,16-17,22,24-25H,5-9H2,1-4H3/t11-,14-,16+,17?,19+,20-/m1/s1 |
| InChIKey | ORLJFXGZZYWOIF-VOYILKFQSA-N |
| Instrument Name | Micromass 70-250S |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np030480i |
| Molecular Weight | 366.454 g/mol |
| Optical Rotation | [a]D20 = +18.4 (c = 0.64, CHCl3) |
| Reported Formula | C20H30O6 |
| SMILES | OC1C(CC[C@@]2([C@]3(CCCC([C@@]3(C([C@@]([C@]2(C)[H])(O)[H])=O)[H])(C)C)C)O)=CC(O1)=O |
| SPLASH | splash10-07vj-6933000000-37f20bf4963b78439357 |
| Source of Spectrum | G4-67-716-1 |
| Wiley ID | 1881732 |