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Cyclohexanone, 2-chloro-3-methyl-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,3.beta.)-(.+-.)-
SpectraBase Compound ID AFZvfGhTLZK
InChI InChI=1S/C23H30ClNOSi/c1-18-12-11-17-21(22(18)24)25-26-27(23(2,3)4,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,18,22H,11-12,17H2,1-4H3/b25-21-/t18-,22+/m0/s1
InChIKey SHYCKBJSFJPGNS-XEKWNIKBSA-N
Mol Weight 400.04 g/mol
Molecular Formula C23H30ClNOSi
Exact Mass 399.178519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6G5JjWdrJVC
Name Cyclohexanone, 2-chloro-3-methyl-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,3.beta.)-(.+-.)-
Alternate Name(s) (1Z,2R,3S)-2-chloro-3-methylcyclohexanone O-[tert-butyl(diphenyl)silyl]oxime (E)-trans-2-chloro-3-methylcyclohexanone O-(tert-butyldiphenyl-silyl)oxime
CAS Registry Number 126872-34-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30ClNOSi
InChI InChI=1S/C23H30ClNOSi/c1-18-12-11-17-21(22(18)24)25-26-27(23(2,3)4,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,18,22H,11-12,17H2,1-4H3/b25-21-/t18-,22+/m0/s1
InChIKey SHYCKBJSFJPGNS-XEKWNIKBSA-N
Molecular Weight 400.037 g/mol
SMILES [C@@]1(\C(=N/O[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)CCC[C@@]1(C)[H])(Cl)[H]
SPLASH splash10-0pb9-8910000000-42d8db9ebf3b06ab4198
Source of Spectrum C-112-3473-0
Wiley ID 1369042