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(1R,2R,4S)-4-[(tert-Butyldimethylsilyl)oxy]-2-(2-chloro-5-pyridyl)-1-[(methylsulfonyl)oxy]cyclohexane
SpectraBase Compound ID EKRtKzynwIo
InChI InChI=1S/C18H30ClNO4SSi/c1-18(2,3)26(5,6)24-14-8-9-16(23-25(4,21)22)15(11-14)13-7-10-17(19)20-12-13/h7,10,12,14-16H,8-9,11H2,1-6H3/t14-,15+,16+/m0/s1
InChIKey SWLOXFZSTWZWFC-ARFHVFGLSA-N
Mol Weight 420.04 g/mol
Molecular Formula C18H30ClNO4SSi
Exact Mass 419.135334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVdsgpcTo8F
Name (1R,2R,4S)-4-[(tert-Butyldimethylsilyl)oxy]-2-(2-chloro-5-pyridyl)-1-[(methylsulfonyl)oxy]cyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30ClNO4SSi
InChI InChI=1S/C18H30ClNO4SSi/c1-18(2,3)26(5,6)24-14-8-9-16(23-25(4,21)22)15(11-14)13-7-10-17(19)20-12-13/h7,10,12,14-16H,8-9,11H2,1-6H3/t14-,15+,16+/m0/s1
InChIKey SWLOXFZSTWZWFC-ARFHVFGLSA-N
Molecular Weight 420.039 g/mol
SMILES [C@]1([C@](C[C@](CC1)(O[Si](C)(C)C(C)(C)C)[H])(c1ccc(nc1)Cl)[H])(OS(=O)(=O)C)[H]
SPLASH splash10-0f96-0900000000-51610175a3144628c2cb
Source of Spectrum K-2001-172-32
Synonyms (1R,2R,4S)-4-{[tert-butyl(dimethyl)silyl]oxy}-2-(6-chloro-3-pyridinyl)cyclohexyl methanesulfonate
Wiley ID 1578376