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Benzenesulfinic acid, 4-[2-[(trimethylsilyl)oxy]ethyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1R-[1.alpha.(S*),2.beta.,5.alpha.]]-
SpectraBase Compound ID IiDzmuKRCYL
InChI InChI=1S/C21H36O3SSi/c1-16(2)20-12-7-17(3)15-21(20)24-25(22)19-10-8-18(9-11-19)13-14-23-26(4,5)6/h8-11,16-17,20-21H,7,12-15H2,1-6H3
InChIKey BUJCPJRBFFDOEZ-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C21H36O3SSi
Exact Mass 396.215443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rXi7zrJcu6
Name Benzenesulfinic acid, 4-[2-[(trimethylsilyl)oxy]ethyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1R-[1.alpha.(S*),2.beta.,5.alpha.]]-
CAS Registry Number 113344-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O3SSi
InChI InChI=1S/C21H36O3SSi/c1-16(2)20-12-7-17(3)15-21(20)24-25(22)19-10-8-18(9-11-19)13-14-23-26(4,5)6/h8-11,16-17,20-21H,7,12-15H2,1-6H3
InChIKey BUJCPJRBFFDOEZ-UHFFFAOYSA-N
Molecular Weight 396.661 g/mol
SMILES C1(OS(c2ccc(cc2)CCO[Si](C)(C)C)=O)C(CCC(C1)C)C(C)C
SPLASH splash10-001i-9310000000-2280f6551878bdd341c4
Source of Spectrum B-40-73-16
Synonyms (-)-Menthyl p-(2-trimethylsiloxyethyl)benzenesulfinate 2-isopropyl-5-methylcyclohexyl 4-{2-[(trimethylsilyl)oxy]ethyl}benzenesulfinate
Wiley ID 1367429