| SpectraBase Compound ID | 4biZDa45WQN |
|---|---|
| InChI | InChI=1S/C30H50O4Si/c1-20(19-34-35(7,8)27(2,3)4)22-9-10-23-26-24(11-12-29(22,23)6)28(5)13-14-30(32-15-16-33-30)18-21(28)17-25(26)31/h17,20,22-24,26H,9-16,18-19H2,1-8H3/t20?,22-,23+,24+,26+,28+,29-/m1/s1 |
| InChIKey | OJIQPPKNMRNKTA-GQKPZGKISA-N |
| Mol Weight | 502.8 g/mol |
| Molecular Formula | C30H50O4Si |
| Exact Mass | 502.347837 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8l1P9cMunAv |
|---|---|
| Name | 3,3-(Ethylidenedioxy)-20-(tert-butyldimethylsilyloxy)-5-pregnen-7-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 502.347836621 u |
| Formula | C30H50O4Si |
| InChI | InChI=1S/C30H50O4Si/c1-20(19-34-35(7,8)27(2,3)4)22-9-10-23-26-24(11-12-29(22,23)6)28(5)13-14-30(32-15-16-33-30)18-21(28)17-25(26)31/h17,20,22-24,26H,9-16,18-19H2,1-8H3/t20?,22-,23+,24+,26+,28+,29-/m1/s1 |
| InChIKey | OJIQPPKNMRNKTA-GQKPZGKISA-N |
| Molecular Weight | 502.811 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(C(C=C4[C@@]([C@]3(CC2)[H])(CCC2(OCCO2)C4)C)=O)[H])(CC[C@@]1(C(CO[Si](C(C)(C)C)(C)C)C)[H])[H])C |