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3-NONAFLUOROBUTYL-17-BETA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-ANDROSTA-3,5-DIENE
SpectraBase Compound ID G7WvzvF61Wg
InChI InChI=1S/C29H41F9OSi/c1-23(2,3)40(6,7)39-22-11-10-20-19-9-8-17-16-18(12-14-24(17,4)21(19)13-15-25(20,22)5)26(30,31)27(32,33)28(34,35)29(36,37)38/h8,16,19-22H,9-15H2,1-7H3/t19-,20-,21-,22-,24-,25-/m0/s1
InChIKey RURGTWFMYGDDQR-BKWLFHPQSA-N
Mol Weight 604.7 g/mol
Molecular Formula C29H41F9OSi
Exact Mass 604.278296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iwvf5FH2Nwv
Name 3-NONAFLUOROBUTYL-17-BETA-[(TERT.-BUTYLDIMETHYLSILYL)-OXY]-ANDROSTA-3,5-DIENE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H41F9OSi
InChI InChI=1S/C29H41F9OSi/c1-23(2,3)40(6,7)39-22-11-10-20-19-9-8-17-16-18(12-14-24(17,4)21(19)13-15-25(20,22)5)26(30,31)27(32,33)28(34,35)29(36,37)38/h8,16,19-22H,9-15H2,1-7H3/t19-,20-,21-,22-,24-,25-/m0/s1
InChIKey RURGTWFMYGDDQR-BKWLFHPQSA-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 604.715 g/mol
Sample ID 968633
Solvent CDCl3