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2,6-Di-tert-butyl-4-methylcyclohexanone
SpectraBase Compound ID 3MJYQzHbR08
InChI InChI=1S/C15H28O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h10-12H,8-9H2,1-7H3
InChIKey LDPDMUPXRDWOPE-UHFFFAOYSA-N
Mol Weight 224.39 g/mol
Molecular Formula C15H28O
Exact Mass 224.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iHBltoDWVC
Name 2,6-Di-tert-butyl-4-methylcyclohexanone
Alternate Name(s) 2,6-Ditert-butyl-4-methyl-1-cyclohexanone 2,6-Ditert-butyl-4-methylcyclohexan-1-one 2,6-Ditert-butyl-4-methyl-cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O
InChI InChI=1S/C15H28O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h10-12H,8-9H2,1-7H3
InChIKey LDPDMUPXRDWOPE-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3ra45600e
Molecular Weight 224.388 g/mol
SMILES C1(C(C(C(C)(C)C)CC(C)C1)=O)C(C)(C)C
SPLASH splash10-0aos-9100000000-fcd7d3bce3a12b13f506
Source of Spectrum RSA-4-2729/SM-Table2,entry13
Wiley ID 1747833