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3-ALPHA-NONAFLUOROBUTYL-17-BETA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-ANDROST-4-EN-3-BETA-OL
SpectraBase Compound ID DqWuXVXjjsu
InChI InChI=1S/C29H43F9O2Si/c1-22(2,3)41(6,7)40-21-11-10-19-18-9-8-17-16-25(39,15-14-23(17,4)20(18)12-13-24(19,21)5)26(30,31)27(32,33)28(34,35)29(36,37)38/h16,18-21,39H,8-15H2,1-7H3/t18-,19-,20-,21-,23-,24-,25-/m0/s1
InChIKey BVYJJXAXIPYIAV-XEYKCJAPSA-N
Mol Weight 622.7 g/mol
Molecular Formula C29H43F9O2Si
Exact Mass 622.288861 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ILfG4L1QWDx
Name 3-ALPHA-NONAFLUOROBUTYL-17-BETA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-ANDROST-4-EN-3-BETA-OL
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H43F9O2Si
InChI InChI=1S/C29H43F9O2Si/c1-22(2,3)41(6,7)40-21-11-10-19-18-9-8-17-16-25(39,15-14-23(17,4)20(18)12-13-24(19,21)5)26(30,31)27(32,33)28(34,35)29(36,37)38/h16,18-21,39H,8-15H2,1-7H3/t18-,19-,20-,21-,23-,24-,25-/m0/s1
InChIKey BVYJJXAXIPYIAV-XEYKCJAPSA-N
Literature Reference Author J.R.WILLIAMS,T.J.SHEA
Literature Reference Citation STEROIDS,61,50(1996)
Literature Reference DOI 10.1016/0039-128x(95)00176-q
Molecular Weight 622.730 g/mol
Sample ID 968624
Solvent CDCl3