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(8.beta.)-8-[(tert-Butyldimethylsilyl)oxy]-des-A,B-18-iodopregnan-20-one
SpectraBase Compound ID KBM7HnxXMWt
InChI InChI=1S/C18H33IO2Si/c1-13(20)14-9-10-15-16(8-7-11-18(14,15)12-19)21-22(5,6)17(2,3)4/h14-16H,7-12H2,1-6H3/t14-,15+,16+,18+/m1/s1
InChIKey ZTBBLZBJLSBMNV-CVYDXHPNSA-N
Mol Weight 436.4 g/mol
Molecular Formula C18H33IO2Si
Exact Mass 436.129452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOoi0BeoVbI
Name (8.beta.)-8-[(tert-Butyldimethylsilyl)oxy]-des-A,B-18-iodopregnan-20-one
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Formula C18H33IO2Si
InChI InChI=1S/C18H33IO2Si/c1-13(20)14-9-10-15-16(8-7-11-18(14,15)12-19)21-22(5,6)17(2,3)4/h14-16H,7-12H2,1-6H3/t14-,15+,16+,18+/m1/s1
InChIKey ZTBBLZBJLSBMNV-CVYDXHPNSA-N
Molecular Weight 436.449 g/mol
SMILES [C@@]12([C@]([C@@](O[Si](C(C)(C)C)(C)C)(CCC2)[H])(CC[C@@]1(C(=O)C)[H])[H])CI
SPLASH splash10-001i-0904000000-8dcc37aa2b2c802c5035
Source of Spectrum J-67-4711-3
Synonyms 1-[(1S,3aR,4S,7aR)-4-[tert-butyl(dimethyl)silyl]oxy-7a-(iodanylmethyl)-1,2,3,3a,4,5,6,7-octahydroinden-1-yl]ethanone
Wiley ID 1570240