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(6E)-2-tert-butyl-6-(4-chlorobenzylidene)cyclohexanone
SpectraBase Compound ID J69HyPTJ6XG
InChI InChI=1S/C17H21ClO/c1-17(2,3)15-6-4-5-13(16(15)19)11-12-7-9-14(18)10-8-12/h7-11,15H,4-6H2,1-3H3/b13-11+
InChIKey CWOOXLJATFYAEI-ACCUITESSA-N
Mol Weight 276.81 g/mol
Molecular Formula C17H21ClO
Exact Mass 276.128093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9zaF5xQZfb
Name (6E)-2-tert-butyl-6-(4-chlorobenzylidene)cyclohexanone
Alternate Name(s) 2-tert-Butyl-6-(4-chlorobenzylidene)cyclohexanone (6E)-2-tert-butyl-6-[(4-chlorophenyl)methylidene]-1-cyclohexanone (6E)-2-tert-butyl-6-[(4-chlorophenyl)methylene]cyclohexanone
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Formula C17H21ClO
InChI InChI=1S/C17H21ClO/c1-17(2,3)15-6-4-5-13(16(15)19)11-12-7-9-14(18)10-8-12/h7-11,15H,4-6H2,1-3H3/b13-11+
InChIKey CWOOXLJATFYAEI-ACCUITESSA-N
Molecular Weight 276.807 g/mol
SMILES c1(Cl)ccc(cc1)\C=C\1C(C(CCC1)C(C)(C)C)=O
SPLASH splash10-00di-7960000000-15084f014d22ed65a756
Wiley ID 1471523