![(5Z,7E)-(1S,3R,20R,24.xi.)-1,3-Bis[[(1,1-dimethylethyl)simethylsilyl]oxy]-20-fluoro-26,27-cyclo-9,10-secocholesta-5,7,10(19)-trien-24-ol](/api/spectrum/9phBBlt7jyG/structure.png?h=300&w=458 "(5Z,7E)-(1S,3R,20R,24.xi.)-1,3-Bis[[(1,1-dimethylethyl)simethylsilyl]oxy]-20-fluoro-26,27-cyclo-9,10-secocholesta-5,7,10(19)-trien-24-ol")
| SpectraBase Compound ID | BveSZh2wP7b |
|---|---|
| InChI | InChI=1S/C39H69FO3Si2/c1-27-30(25-31(42-44(10,11)36(2,3)4)26-34(27)43-45(12,13)37(5,6)7)19-16-28-15-14-23-38(8)32(28)20-21-35(38)39(9,40)24-22-33(41)29-17-18-29/h16,19,29,31-35,41H,1,14-15,17-18,20-26H2,2-13H3/b28-16+,30-19-/t31-,32-,33?,34+,35+,38+,39-/m1/s1 |
| InChIKey | FHCMVBRWPDWXJU-SCYWFMGESA-N |
| Mol Weight | 661.1 g/mol |
| Molecular Formula | C39H69FO3Si2 |
| Exact Mass | 660.476927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9phBBlt7jyG |
|---|---|
| Name | (5Z,7E)-(1S,3R,20R,24.xi.)-1,3-Bis[[(1,1-dimethylethyl)simethylsilyl]oxy]-20-fluoro-26,27-cyclo-9,10-secocholesta-5,7,10(19)-trien-24-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C39H69FO3Si2 |
| InChI | InChI=1S/C39H69FO3Si2/c1-27-30(25-31(42-44(10,11)36(2,3)4)26-34(27)43-45(12,13)37(5,6)7)19-16-28-15-14-23-38(8)32(28)20-21-35(38)39(9,40)24-22-33(41)29-17-18-29/h16,19,29,31-35,41H,1,14-15,17-18,20-26H2,2-13H3/b28-16+,30-19-/t31-,32-,33?,34+,35+,38+,39-/m1/s1 |
| InChIKey | FHCMVBRWPDWXJU-SCYWFMGESA-N |
| Molecular Weight | 661.146 g/mol |
| SMILES | OC(C1CC1)CC[C@]([C@@]1([C@@]2([C@@](\C(=C\C=C/3C([C@@](O[Si](C(C)(C)C)(C)C)(C[C@@](C3)(O[Si](C(C)(C)C)(C)C)[H])[H])=C)CCC2)(CC1)[H])C)[H])(F)C |
| SPLASH | splash10-0002-0090052000-e5cd685df3beb9eca10e |
| Source of Spectrum | F-51-9549-18 |
| Wiley ID | 793229 |