![(3 beta)-3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,16-dien-20-yl-Hydroperoxide](/api/spectrum/8SfPPQsFbxU/structure.png?h=300&w=458 "(3 beta)-3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,16-dien-20-yl-Hydroperoxide")
| SpectraBase Compound ID | 9fiVCV9vmGI |
|---|---|
| InChI | InChI=1S/C27H46O3Si/c1-18(29-28)22-11-12-23-21-10-9-19-17-20(30-31(7,8)25(2,3)4)13-15-26(19,5)24(21)14-16-27(22,23)6/h9,11,18,20-21,23-24,28H,10,12-17H2,1-8H3/t18-,20-,21-,23-,24-,26-,27+/m0/s1 |
| InChIKey | ILYLREOMDRLMOM-CLXTWXEMSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C27H46O3Si |
| Exact Mass | 446.321622 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8SfPPQsFbxU |
|---|---|
| Name | (3 beta)-3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,16-dien-20-yl-Hydroperoxide |
| Alternate Name(s) | (3beta,20S)-3-{[tert-butyl(dimethyl)silyl]oxy}pregna-5,16-dien-20-yl hydroperoxide 3-{[(t-Butyl)dimethylsilyl]oxy}-21-norpregna-5,16-dien-20-yl-Hydroperoxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O3Si |
| InChI | InChI=1S/C27H46O3Si/c1-18(29-28)22-11-12-23-21-10-9-19-17-20(30-31(7,8)25(2,3)4)13-15-26(19,5)24(21)14-16-27(22,23)6/h9,11,18,20-21,23-24,28H,10,12-17H2,1-8H3/t18-,20-,21-,23-,24-,26-,27+/m0/s1 |
| InChIKey | ILYLREOMDRLMOM-CLXTWXEMSA-N |
| Molecular Weight | 446.747 g/mol |
| SMILES | OO[C@](C=1[C@@]2([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](O[Si](C(C)(C)C)(C)C)(C4)[H])C)[H])(CC1)[H])C)(C)[H] |
| SPLASH | splash10-004i-9002000000-a685d1c8a32991775d14 |
| Source of Spectrum | H-87-3001-8 |
| Wiley ID | 1564178 |