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Cyclohexanone, 2-chloro-5-(1,1-dimethylethyl)-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,5.beta.)-(.+-.)-
SpectraBase Compound ID GasZzA4Q2Ce
InChI InChI=1S/C26H36ClNOSi/c1-25(2,3)20-17-18-23(27)24(19-20)28-29-30(26(4,5)6,21-13-9-7-10-14-21)22-15-11-8-12-16-22/h7-16,20,23H,17-19H2,1-6H3/b28-24-/t20-,23-/m1/s1
InChIKey KVUCBSWIJSSQJC-GMEXYIGFSA-N
Mol Weight 442.1 g/mol
Molecular Formula C26H36ClNOSi
Exact Mass 441.225469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOX5vOGXOte
Name Cyclohexanone, 2-chloro-5-(1,1-dimethylethyl)-, O-[(1,1-dimethylethyl)diphenylsilyl]oxime, (1E,2.alpha.,5.beta.)-(.+-.)-
CAS Registry Number 126754-37-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36ClNOSi
InChI InChI=1S/C26H36ClNOSi/c1-25(2,3)20-17-18-23(27)24(19-20)28-29-30(26(4,5)6,21-13-9-7-10-14-21)22-15-11-8-12-16-22/h7-16,20,23H,17-19H2,1-6H3/b28-24-/t20-,23-/m1/s1
InChIKey KVUCBSWIJSSQJC-GMEXYIGFSA-N
Molecular Weight 442.118 g/mol
SMILES C1\C(=N\O[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)[C@@](CC[C@]1(C(C)(C)C)[H])(Cl)[H]
SPLASH splash10-0540-1319000000-0273e74c21afaf4df8eb
Source of Spectrum C-112-3473-0
Synonyms (1Z,2R,5R)-5-tert-butyl-2-chlorocyclohexanone O-[tert-butyl(diphenyl)silyl]oxime (E)-trans-2-chloro-5-(1,1-dimethylethyl)cyclohexanone O-(tert-butyldiphenylsilyl)oxime
Wiley ID 1385104