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2-Bromo, 4-phenylcyclohexanone
SpectraBase Compound ID BJbPq9nc9xD
InChI InChI=1S/C12H13BrO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
InChIKey ZBWHAEPVTLBSAG-UHFFFAOYSA-N
Mol Weight 253.14 g/mol
Molecular Formula C12H13BrO
Exact Mass 252.014978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9psKOjqFsWt
Name 2-Bromo, 4-phenylcyclohexanone
Alternate Name(s) 2-Bromo-4-phenylcyclohexanone 2-Bromo-4-phenyl-1-cyclohexanone 2-Bromo-4-phenylcyclohexan-1-one 2-Bromanyl-4-phenyl-cyclohexan-1-one
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Formula C12H13BrO
InChI InChI=1S/C12H13BrO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
InChIKey ZBWHAEPVTLBSAG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo102239x
Molecular Weight 253.139 g/mol
SMILES C1C(C(CC(C1)c1ccccc1)Br)=O
SPLASH splash10-0uxr-0790000000-5fcb5d06050618df398b
Source of Spectrum J-76-736/SM12-3j
Wiley ID 1755578