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(1"S,2S,2'S,6'R,8'S,9'S,11'R)-4-[8'-[1"-[[(tert-Butyldiphenylsilyl)oxy]methyl]propyl]-9',11'-dimethyl-1',7'-dioxaspiro[5.5]undec-4'-en-2'-yl]-1-iodo-2-methyl-2-butanol
SpectraBase Compound ID JqdAWyoqOQA
InChI InChI=1S/C36H53IO4Si/c1-8-29(25-39-42(34(4,5)6,31-17-11-9-12-18-31)32-19-13-10-14-20-32)33-27(2)24-28(3)36(41-33)22-15-16-30(40-36)21-23-35(7,38)26-37/h9-15,17-20,22,27-30,33,38H,8,16,21,23-26H2,1-7H3/t27-,28+,29-,30-,33-,35?,36-/m0/s1
InChIKey VQPZBPMOOJTCEN-GUDKJATQSA-N
Mol Weight 704.8 g/mol
Molecular Formula C36H53IO4Si
Exact Mass 704.275782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Oq8C8kAlEm
Name (1"S,2S,2'S,6'R,8'S,9'S,11'R)-4-[8'-[1"-[[(tert-Butyldiphenylsilyl)oxy]methyl]propyl]-9',11'-dimethyl-1',7'-dioxaspiro[5.5]undec-4'-en-2'-yl]-1-iodo-2-methyl-2-butanol
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Formula C36H53IO4Si
InChI InChI=1S/C36H53IO4Si/c1-8-29(25-39-42(34(4,5)6,31-17-11-9-12-18-31)32-19-13-10-14-20-32)33-27(2)24-28(3)36(41-33)22-15-16-30(40-36)21-23-35(7,38)26-37/h9-15,17-20,22,27-30,33,38H,8,16,21,23-26H2,1-7H3/t27-,28+,29-,30-,33-,35?,36-/m0/s1
InChIKey VQPZBPMOOJTCEN-GUDKJATQSA-N
Molecular Weight 704.805 g/mol
SMILES OC(CC[C@]1(O[C@]2(O[C@]([C@](CO[Si](C(C)(C)C)(c3ccccc3)c3ccccc3)(CC)[H])([C@](C[C@]2(C)[H])(C)[H])[H])C=CC1)[H])(CI)C
SPLASH splash10-0002-0932003000-1428ced69d39252d4a10
Source of Spectrum J-57-5821-14
Synonyms (1''S,2S,2'S,6'R,8'S,9'S,11'R)-4-[8'-[1''-[[(tert-Butyldiphenylsilyl)oxy]methyl]propyl]-9',11'-dimethyl-1',7'-dioxaspiro[5.5]undec-4'-en-2'-yl]-1-iodo-2-methyl-2-butanol 4-{(2R,6R,8S,9S,11R)-8-[(1S)-1-({[tert-butyl(diphenyl)silyl]oxy}methyl)propyl]-9,11-dimethyl-1,7-dioxaspiro[5.5]undec-4-en-2-yl}-1-iodo-2-methyl-2-butanol
Wiley ID 1415155