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3aH-Indene-3a-carboxylic acid, 1-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-methylethyl]octahydro-4-oxo-, methyl ester, [1.alpha.(R*),3a.alpha.,7a.beta.]-(.+-.)-
SpectraBase Compound ID Gr7krwSdVqJ
InChI InChI=1S/C20H36O4Si/c1-14(13-24-25(6,7)19(2,3)4)15-11-12-20(18(22)23-5)16(15)9-8-10-17(20)21/h14-16H,8-13H2,1-7H3/t14?,15-,16-,20+/m1/s1
InChIKey MQBJVECFKBQQBD-GSRQHLLESA-N
Mol Weight 368.6 g/mol
Molecular Formula C20H36O4Si
Exact Mass 368.238286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqpbibheKoe
Name 3aH-Indene-3a-carboxylic acid, 1-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-methylethyl]octahydro-4-oxo-, methyl ester, [1.alpha.(R*),3a.alpha.,7a.beta.]-(.+-.)-
CAS Registry Number 112946-33-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O4Si
InChI InChI=1S/C20H36O4Si/c1-14(13-24-25(6,7)19(2,3)4)15-11-12-20(18(22)23-5)16(15)9-8-10-17(20)21/h14-16H,8-13H2,1-7H3/t14?,15-,16-,20+/m1/s1
InChIKey MQBJVECFKBQQBD-GSRQHLLESA-N
Molecular Weight 368.589 g/mol
SMILES [C@]12([C@@]([C@@](C(CO[Si](C(C)(C)C)(C)C)C)(CC2)[H])(CCCC1=O)[H])C(=O)OC
SPLASH splash10-03di-9406000000-3620440a38501f8ddbf5
Source of Spectrum C-111-7516-65
Synonyms Methyl (1S,3aS,7aR)-1-(2-{[tert-butyl(dimethyl)silyl]oxy}-1-methylethyl)-4-oxooctahydro-3aH-indene-3a-carboxylate rel-(1R,3aR,4R,7aS)-methyl 1-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1(S)-methylethyl]-1,2,3,4,5,6,7,7a-octahydro-4-hydroxy-3ah-indene-3a-carboxylate rel-(1R,3aR,7aS)-methyl 1-[2-[[(1,1-dimethylethyl)dimethylsilyl]-oxy]-1(S)-methylethyl]-1,2,3,4,5,6,7,7a-octahydro-4-oxo-3ah-indene-3a-carboxylate
Wiley ID 1353030