![3.xi.-[3'.beta.-Tert-butyldimethylsilyloxyandrost-5'-en-17'.beta.-yl]-1-(hydroxyimino)cyclobutane](/api/spectrum/7HCkUOtWTz/structure.png?h=300&w=458 "3.xi.-[3'.beta.-Tert-butyldimethylsilyloxyandrost-5'-en-17'.beta.-yl]-1-(hydroxyimino)cyclobutane")
| SpectraBase Compound ID | EruVicgGayP |
|---|---|
| InChI | InChI=1S/C29H49NO2Si/c1-27(2,3)33(6,7)32-22-12-14-28(4)20(18-22)8-9-23-25-11-10-24(19-16-21(17-19)30-31)29(25,5)15-13-26(23)28/h8,19,22-26,31H,9-18H2,1-7H3/b30-21-/t19?,22-,23-,24+,25-,26-,28-,29+/m0/s1 |
| InChIKey | JEHBGRWSBVRLCO-WJLRLXHHSA-N |
| Mol Weight | 471.8 g/mol |
| Molecular Formula | C29H49NO2Si |
| Exact Mass | 471.353256 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7HCkUOtWTz |
|---|---|
| Name | 3.xi.-[3'.beta.-Tert-butyldimethylsilyloxyandrost-5'-en-17'.beta.-yl]-1-(hydroxyimino)cyclobutane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 471.353256355 u |
| Formula | C29H49NO2Si |
| InChI | InChI=1S/C29H49NO2Si/c1-27(2,3)33(6,7)32-22-12-14-28(4)20(18-22)8-9-23-25-11-10-24(19-16-21(17-19)30-31)29(25,5)15-13-26(23)28/h8,19,22-26,31H,9-18H2,1-7H3/b30-21-/t19?,22-,23-,24+,25-,26-,28-,29+/m0/s1 |
| InChIKey | JEHBGRWSBVRLCO-WJLRLXHHSA-N |
| Molecular Weight | 471.801 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](O[Si](C(C)(C)C)(C)C)(C4)[H])C)[H])(CC[C@@]1(C1CC(C1)=NO)[H])[H])C |