| SpectraBase Compound ID | H9GeNUrF22K |
|---|---|
| InChI | InChI=1S/C25H44O2Si/c1-9-10-16-24(5)20-15-17-25(6)19(18(20)11-13-21(24)26)12-14-22(25)27-28(7,8)23(2,3)4/h9,18-20,22H,1,10-17H2,2-8H3/t18-,19-,20-,22-,24+,25-/m0/s1 |
| InChIKey | LWDYRNQYHUDVFX-FJZBUURQSA-N |
| Mol Weight | 404.7 g/mol |
| Molecular Formula | C25H44O2Si |
| Exact Mass | 404.311057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 20iwfNpQXWs |
|---|---|
| Name | 17-.beta.-Hydroxy-4,5-secoandrost-3-en-5-one tert-butyldimethylsilyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 404.311057190 u |
| Formula | C25H44O2Si |
| InChI | InChI=1S/C25H44O2Si/c1-9-10-16-24(5)20-15-17-25(6)19(18(20)11-13-21(24)26)12-14-22(25)27-28(7,8)23(2,3)4/h9,18-20,22H,1,10-17H2,2-8H3/t18-,19-,20-,22-,24+,25-/m0/s1 |
| InChIKey | LWDYRNQYHUDVFX-FJZBUURQSA-N |
| Molecular Weight | 404.710 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(CCC([C@@]([C@]3(CC2)[H])(CCC=C)C)=O)[H])(CC[C@@]1(O[Si](C(C)(C)C)(C)C)[H])[H])C |