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4-(2,2,6-Trimethylcyclohexyl)-2-butanone

View entire compound with spectra: 1 FTIR, and 7 MS (GC)

4-(2,2,6-Trimethylcyclohexyl)-2-butanone
SpectraBase Compound ID DCfxo8YFdrk
InChI InChI=1S/C13H24O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h10,12H,5-9H2,1-4H3
InChIKey PQCDGQHNORPNBR-UHFFFAOYSA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CPAkQVM3vz
Name 4-(2,2,6-Trimethylcyclohexyl)-2-butanone
Alternate Name(s) 2-Butanone, 4-(2,2,6-trimethylcyclohexyl)- 4-(2,2,6-trimethylcyclohexyl)butan-2-one
CAS Registry Number 6138-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h10,12H,5-9H2,1-4H3
InChIKey PQCDGQHNORPNBR-UHFFFAOYSA-N
Molecular Weight 196.334 g/mol
SMILES C1(C(CCCC1C)(C)C)CCC(=O)C
SPLASH splash10-05uu-9200000000-3fd4a155ce451ecb406a
Source of Spectrum PR-227-0-0
Wiley ID 1193973