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Benzene, 1-[1-chloro-4-(1,1-dimethylethyl)cyclohexyl]-4-nitro-, cis-
SpectraBase Compound ID LWSf2GOm1Ns
InChI InChI=1S/C16H22ClNO2/c1-15(2,3)12-8-10-16(17,11-9-12)13-4-6-14(7-5-13)18(19)20/h4-7,12H,8-11H2,1-3H3/t12-,16-
InChIKey DHUYGSWVJPBEOU-YGUOUDRMSA-N
Mol Weight 295.81 g/mol
Molecular Formula C16H22ClNO2
Exact Mass 295.133907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cE6t8upeSb
Name Benzene, 1-[1-chloro-4-(1,1-dimethylethyl)cyclohexyl]-4-nitro-, cis-
CAS Registry Number 89727-60-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22ClNO2
InChI InChI=1S/C16H22ClNO2/c1-15(2,3)12-8-10-16(17,11-9-12)13-4-6-14(7-5-13)18(19)20/h4-7,12H,8-11H2,1-3H3/t12-,16-
InChIKey DHUYGSWVJPBEOU-YGUOUDRMSA-N
Molecular Weight 295.810 g/mol
SMILES c1(N(=O)=O)ccc([C@]2(CC[C@@](C(C)(C)C)(CC2)[H])Cl)cc1
SPLASH splash10-0a4l-9020000000-f4f8af9bc787f7ff998d
Source of Spectrum C-106-3143-0
Synonyms 1-(4-tert-butyl-1-chlorocyclohexyl)-4-nitrobenzene c-4-tert-butyl-r-1-chloro-1-(p-nitrophenyl)cyclohexane
Wiley ID 1298175