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4H-1,3-Benzodioxin-4-one, 2-(1,1-dimethylethyl)-5-(dimethylphenylsilyl)hexahydro-, [2S-(2.alpha.,4a.alpha.,5.beta.,8a.beta.)]-
SpectraBase Compound ID D6Kg2LkE6SI
InChI InChI=1S/C20H30O3Si/c1-20(2,3)19-22-15-12-9-13-16(17(15)18(21)23-19)24(4,5)14-10-7-6-8-11-14/h6-8,10-11,15-17,19H,9,12-13H2,1-5H3/t15-,16+,17+,19-/m0/s1
InChIKey QVMHNOOBVBJWBZ-FAJBIJEISA-N
Mol Weight 346.54 g/mol
Molecular Formula C20H30O3Si
Exact Mass 346.196421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvK1tWPvgIT
Name 4H-1,3-Benzodioxin-4-one, 2-(1,1-dimethylethyl)-5-(dimethylphenylsilyl)hexahydro-, [2S-(2.alpha.,4a.alpha.,5.beta.,8a.beta.)]-
Alternate Name(s) (2S,4aS,5R,8aS)-2-(t-butyl)-5-[dimethyl(phenyl)silyl]perhydro-2H,4H-[1,3]benzodioxin-4-one (2S,4aS,5R,8aS)-2-tert-butyl-5-[dimethyl(phenyl)silyl]hexahydro-4H-1,3-benzodioxin-4-one
CAS Registry Number 113121-97-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3Si
InChI InChI=1S/C20H30O3Si/c1-20(2,3)19-22-15-12-9-13-16(17(15)18(21)23-19)24(4,5)14-10-7-6-8-11-14/h6-8,10-11,15-17,19H,9,12-13H2,1-5H3/t15-,16+,17+,19-/m0/s1
InChIKey QVMHNOOBVBJWBZ-FAJBIJEISA-N
Molecular Weight 346.542 g/mol
SMILES C1([C@]2([C@]([Si](c3ccccc3)(C)C)(CCC[C@]2([H])O[C@@](O1)(C(C)(C)C)[H])[H])[H])=O
SPLASH splash10-001a-0940000000-c4ca217307f7b9c3d264
Source of Spectrum H-72-709-14
Wiley ID 1339412