| SpectraBase Compound ID | JjmAYR7Wlra |
|---|---|
| InChI | InChI=1S/C29H49FO/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,18-27,31H,7,10-17H2,1-6H3/b9-8+/t19-,20+,21+,22?,23-,24?,25?,26?,27-,28-,29-/m1/s1 |
| InChIKey | ROFIIEFDKODGLZ-GJLKBINGSA-N |
| Mol Weight | 432.7 g/mol |
| Molecular Formula | C29H49FO |
| Exact Mass | 432.376744 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3jyJzvGjaDg |
|---|---|
| Name | (22E)-3-BETA-FLUORO-6-BETA-HYDROXYSTIGMAST-22-ENE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H49FO |
| InChI | InChI=1S/C29H49FO/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,18-27,31H,7,10-17H2,1-6H3/b9-8+/t19-,20+,21+,22?,23-,24?,25?,26?,27-,28-,29-/m1/s1 |
| InChIKey | ROFIIEFDKODGLZ-GJLKBINGSA-N |
| Literature Reference Author | L.R.GALAGOVSKY,E.G.GROS,J.A.RAMIREZ |
| Literature Reference Citation | PHYTOCHEM.,58,973(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00379-X |
| Solvent | Unknown |
| Source File Reference | UWLU3056 |