| SpectraBase Compound ID | CXkQMcbpAEb |
|---|---|
| InChI | InChI=1S/C29H58O3Si3/c1-12-29(32-35(9,10)11)27(31-34(6,7)8)20-26-25-15-13-21-19-22(30-33(3,4)5)14-16-23(21)24(25)17-18-28(26,29)2/h21-27H,12-20H2,1-11H3/t21?,22?,23?,24?,25?,26?,27?,28?,29-/m0/s1 |
| InChIKey | QBCQIXWHJHAYTC-OIWYXFDRSA-N |
| Mol Weight | 539.0 g/mol |
| Molecular Formula | C29H58O3Si3 |
| Exact Mass | 538.369375 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Aj1SuhOi2ts |
|---|---|
| Name | 19-Nor-pregnane-3,16,17-triol - tris(trimethylsilyl) derivative |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H58O3Si3 |
| InChI | InChI=1S/C29H58O3Si3/c1-12-29(32-35(9,10)11)27(31-34(6,7)8)20-26-25-15-13-21-19-22(30-33(3,4)5)14-16-23(21)24(25)17-18-28(26,29)2/h21-27H,12-20H2,1-11H3/t21?,22?,23?,24?,25?,26?,27?,28?,29-/m0/s1 |
| InChIKey | QBCQIXWHJHAYTC-OIWYXFDRSA-N |
| Molecular Weight | 539.035 g/mol |
| SMILES | [C@@]1(C2(C(C3CCC4C(C3CC2)CCC(O[Si](C)(C)C)C4)CC1O[Si](C)(C)C)C)(O[Si](C)(C)C)CC |
| SPLASH | splash10-001i-0390000000-42933fcfbee1ca2baac3 |
| Source of Spectrum | O-36-149-5 |
| Wiley ID | 848729 |