(-)-(2S,5S,6S,8S,9S,11S)-11-[(tert-butyldiphenylsiloxy)methyl]-9-methyl-2-phenyl-5-[2-phenylsulphonyl)ethyl]-1,3-dioxaspiro[5.5]undecan-8-ol

SpectraBase Compound ID	J05DCfO0aoe
InChI	InChI=1S/C41H50O6SSi/c1-31-27-34(30-46-49(40(2,3)4,36-21-13-7-14-22-36)37-23-15-8-16-24-37)41(28-38(31)42)33(25-26-48(43,44)35-19-11-6-12-20-35)29-45-39(47-41)32-17-9-5-10-18-32/h5-24,31,33-34,38-39,42H,25-30H2,1-4H3/t31-,33-,34-,38-,39-,41-/m0/s1
InChIKey	HNMXNKLYUMBWGA-SFLYPZRESA-N Google Search
Mol Weight	699.0 g/mol
Molecular Formula	C41H50O6SSi
Exact Mass	698.309737 g/mol

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SpectraBase Spectrum ID	FW4KENI78ns
Name	(-)-(2S,5S,6S,8S,9S,11S)-11-[(tert-butyldiphenylsiloxy)methyl]-9-methyl-2-phenyl-5-[2-phenylsulphonyl)ethyl]-1,3-dioxaspiro[5.5]undecan-8-ol
Alternate Name(s)	(2S,5S,6S,8S,9S,11S)-11-({[tert-butyl(diphenyl)silyl]oxy}methyl)-9-methyl-2-phenyl-5-[2-(phenylsulfonyl)ethyl]-1,3-dioxaspiro[5.5]undecan-8-ol
CAS Registry Number	127910-97-8
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C41H50O6SSi
InChI	InChI=1S/C41H50O6SSi/c1-31-27-34(30-46-49(40(2,3)4,36-21-13-7-14-22-36)37-23-15-8-16-24-37)41(28-38(31)42)33(25-26-48(43,44)35-19-11-6-12-20-35)29-45-39(47-41)32-17-9-5-10-18-32/h5-24,31,33-34,38-39,42H,25-30H2,1-4H3/t31-,33-,34-,38-,39-,41-/m0/s1
InChIKey	HNMXNKLYUMBWGA-SFLYPZRESA-N
Molecular Weight	698.990 g/mol
SMILES	O[C@]1(C[C@@]2(O[C@@](c3ccccc3)(OC[C@@]2(CCS(=O)(=O)c2ccccc2)[H])[H])[C@@](C[C@@]1(C)[H])(CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)[H])[H]
SPLASH	splash10-0002-0900004000-83bc2c30784abc0b6f25
Source of Spectrum	F-45-7182-29
Wiley ID	1415004