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(8S,20S)-des-A,B-20-(2'S-Hydroxy-3',3'-difluoro-3'-ethoxycarbonylpropyl)-8.beta.-[(triethylsilyl)oxy]pregnane
SpectraBase Compound ID FdyHJWbXRkl
InChI InChI=1S/C24H44F2O4Si/c1-7-29-22(28)24(25,26)21(27)16-17(5)18-13-14-19-20(12-11-15-23(18,19)6)30-31(8-2,9-3)10-4/h17-21,27H,7-16H2,1-6H3/t17-,18+,19-,20-,21-,23+/m0/s1
InChIKey NAEKPURTPJFZEO-IKHCIZMXSA-N
Mol Weight 462.7 g/mol
Molecular Formula C24H44F2O4Si
Exact Mass 462.297693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRXadijRbTG
Name (8S,20S)-des-A,B-20-(2'S-Hydroxy-3',3'-difluoro-3'-ethoxycarbonylpropyl)-8.beta.-[(triethylsilyl)oxy]pregnane
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Formula C24H44F2O4Si
InChI InChI=1S/C24H44F2O4Si/c1-7-29-22(28)24(25,26)21(27)16-17(5)18-13-14-19-20(12-11-15-23(18,19)6)30-31(8-2,9-3)10-4/h17-21,27H,7-16H2,1-6H3/t17-,18+,19-,20-,21-,23+/m0/s1
InChIKey NAEKPURTPJFZEO-IKHCIZMXSA-N
Instrument Name Micromass AutoSpec
Ionization Type EI
Molecular Weight 462.694 g/mol
SMILES O[C@@](C[C@@]([C@@]1([C@]2(CCC[C@@]([C@@]2(CC1)[H])(O[Si](CC)(CC)CC)[H])C)[H])(C)[H])(C(C(OCC)=O)(F)F)[H]
SPLASH splash10-014i-3711900000-dd22cb3c8d125362817e
Source of Spectrum US20160347710A1
Wiley ID 1853179