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2-Butanone, 4-[4-(1,1-dimethylethyl)cyclohexyl]-, trans-
SpectraBase Compound ID 78PLiwiatU2
InChI InChI=1S/C14H26O/c1-11(15)5-6-12-7-9-13(10-8-12)14(2,3)4/h12-13H,5-10H2,1-4H3/t12-,13-
InChIKey WUMKAFQCGGIEHT-JOCQHMNTSA-N
Mol Weight 210.36 g/mol
Molecular Formula C14H26O
Exact Mass 210.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6sTbT4uNKW
Name 2-Butanone, 4-[4-(1,1-dimethylethyl)cyclohexyl]-, trans-
Alternate Name(s) 4-(4-tert-butylcyclohexyl)-2-butanone trans-4-(4'-t-butylcyclohexyl)-2-butanone
CAS Registry Number 88166-10-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O
InChI InChI=1S/C14H26O/c1-11(15)5-6-12-7-9-13(10-8-12)14(2,3)4/h12-13H,5-10H2,1-4H3/t12-,13-
InChIKey WUMKAFQCGGIEHT-JOCQHMNTSA-N
Molecular Weight 210.361 g/mol
SMILES C([C@]1(CC[C@@](CC1)(CCC(=O)C)[H])[H])(C)(C)C
SPLASH splash10-0a4l-9100000000-2b03d73b379b77d305aa
Source of Spectrum H-66-1352-0
Wiley ID 1209834