| SpectraBase Spectrum ID |
KwqA5LVwxkg |
| Name |
Estra-1,3,5(10)-trien-17-one, 3-[[(1,1-dimethylethyl)dimethylsilyl]o xy]-16-(2-propynyl)-, (16.alpha.)- |
| Alternate Name(s) |
(16alpha)-3-{[tert-butyl(dimethyl)silyl]oxy}-16-(2-propynyl)estra-1,3,5(10)-trien-17-one
16.alpha.-(2-propynyl)-3-[(tert-butyldimethylsilyl)oxy]estra-1,3,5(10)-trien-17-one |
| CAS Registry Number |
106139-62-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H38O2Si |
| InChI |
InChI=1S/C27H38O2Si/c1-8-9-19-17-24-23-12-10-18-16-20(29-30(6,7)26(2,3)4)11-13-21(18)22(23)14-15-27(24,5)25(19)28/h1,11,13,16,19,22-24H,9-10,12,14-15,17H2,2-7H3/t19-,22-,23-,24+,27+/m1/s1 |
| InChIKey |
POOCHWYOMXMMAI-DSPUUDBWSA-N |
| Molecular Weight |
422.684 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(O[Si](C(C)(C)C)(C)C)c4)[H])(C[C@](C1=O)(CC#C)[H])[H])C |
| SPLASH |
splash10-00xr-0007900000-8b929ae2e54586287c0f |
| Source of Spectrum |
J-52-250-5 |
| Wiley ID |
1378772 |
![Estra-1,3,5(10)-trien-17-one, 3-[[(1,1-dimethylethyl)dimethylsilyl]o xy]-16-(2-propynyl)-, (16.alpha.)-](/api/spectrum/KwqA5LVwxkg/structure.png?h=300&w=458 "Estra-1,3,5(10)-trien-17-one, 3-[[(1,1-dimethylethyl)dimethylsilyl]o xy]-16-(2-propynyl)-, (16.alpha.)-")
