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2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl methanesulfonate
SpectraBase Compound ID 4Lw4uqWrDk1
InChI InChI=1S/C27H44O5SSi/c1-25(2,3)34(6,7)32-20-9-11-21-19(18-20)8-10-23-22(21)12-14-26(4)24(23)13-15-27(26,28)16-17-31-33(5,29)30/h9,11,18,22-24,28H,8,10,12-17H2,1-7H3/t22-,23-,24+,26+,27-/m1/s1
InChIKey UVODAJPVGPPTNH-OBOOOKMBSA-N
Mol Weight 508.8 g/mol
Molecular Formula C27H44O5SSi
Exact Mass 508.267872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dpxHePrLu0
Name 2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl methanesulfonate
Alternate Name(s) 2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl methanesulfonate Methanesulfonic acid 2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl ester
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Formula C27H44O5SSi
InChI InChI=1S/C27H44O5SSi/c1-25(2,3)34(6,7)32-20-9-11-21-19(18-20)8-10-23-22(21)12-14-26(4)24(23)13-15-27(26,28)16-17-31-33(5,29)30/h9,11,18,22-24,28H,8,10,12-17H2,1-7H3/t22-,23-,24+,26+,27-/m1/s1
InChIKey UVODAJPVGPPTNH-OBOOOKMBSA-N
Molecular Weight 508.789 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(O[Si](C(C)(C)C)(C)C)c4)[H])(CC1)[H])C)CCOS(=O)(=O)C
SPLASH splash10-03di-0000920000-a15bb28fe11b9a0de626
Source of Spectrum E1-38-2347-9
Wiley ID 1598404