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Cyclohexanone, 2-chloro-3-(1-methylethyl)-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,3.beta.)-(.+-.)-
SpectraBase Compound ID 2A73Ai1zbvU
InChI InChI=1S/C25H34ClNOSi/c1-19(2)22-17-12-18-23(24(22)26)27-28-29(25(3,4)5,20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19,22,24H,12,17-18H2,1-5H3/b27-23-/t22-,24-/m1/s1
InChIKey FSEDFYIQIKCZCP-VBEAZTEHSA-N
Mol Weight 428.1 g/mol
Molecular Formula C25H34ClNOSi
Exact Mass 427.209819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjlOeteyrL5
Name Cyclohexanone, 2-chloro-3-(1-methylethyl)-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,3.beta.)-(.+-.)-
Alternate Name(s) (1Z,2R,3R)-2-chloro-3-isopropylcyclohexanone O-[tert-butyl(diphenyl)silyl]oxime (E)-trans-2-chloro-3-(1-methylethyl)cyclohexanone O-(tert-butyl-diphenylsilyl)oxime
CAS Registry Number 126872-36-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34ClNOSi
InChI InChI=1S/C25H34ClNOSi/c1-19(2)22-17-12-18-23(24(22)26)27-28-29(25(3,4)5,20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19,22,24H,12,17-18H2,1-5H3/b27-23-/t22-,24-/m1/s1
InChIKey FSEDFYIQIKCZCP-VBEAZTEHSA-N
Molecular Weight 428.091 g/mol
SMILES [C@@]1(\C(=N/O[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)CCC[C@@]1(C(C)C)[H])(Cl)[H]
SPLASH splash10-00di-0429000000-d94cbc69051a661234b9
Source of Spectrum C-112-3473-0
Wiley ID 1380437