| SpectraBase Compound ID | GoNSTsdIKQL |
|---|---|
| InChI | InChI=1S/C20H30O3/c1-7-12(2)16(22)23-17-18(4,5)14-9-8-13(3)20(14)11-10-15(21)19(17,20)6/h7,10-11,13-15,17,21H,8-9H2,1-6H3/b12-7-/t13-,14?,15+,17+,19+,20?/m1/s1 |
| InChIKey | HLZJSQQUPSXGEN-NSGKDLDMSA-N |
| Mol Weight | 318.46 g/mol |
| Molecular Formula | C20H30O3 |
| Exact Mass | 318.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6PDanVvS7pS |
|---|---|
| Name | 3.beta.-Hydroxy-5.alpha.-angeloyloxysilphinene |
| Appearance | oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O3 |
| InChI | InChI=1S/C20H30O3/c1-7-12(2)16(22)23-17-18(4,5)14-9-8-13(3)20(14)11-10-15(21)19(17,20)6/h7,10-11,13-15,17,21H,8-9H2,1-6H3/b12-7-/t13-,14?,15+,17+,19+,20?/m1/s1 |
| InChIKey | HLZJSQQUPSXGEN-NSGKDLDMSA-N |
| Instrument Name | Autospect |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np0105533 |
| Molecular Weight | 318.457 g/mol |
| Optical Rotation | [a]D = +3 (c = 0.84, CHCl3) |
| Reported Formula | C20H30O3 |
| SMILES | O[C@]1(C=CC23[C@@]1([C@](C(C3CC[C@]2(C)[H])(C)C)(OC(=O)\C(=C/C)C)[H])C)[H] |
| SPLASH | splash10-0159-7290000000-fb53e097235301d573bd |
| Source of Spectrum | G4-65-452-8 |
| Wiley ID | 1883627 |