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Back ChemicalBook Home>CAS DataBase List>712-50-5More Spectrum> Benzoylcyclohexane(712-50-5) IR1

Benzoylcyclohexane(712-50-5) IR1

Product NameBenzoylcyclohexane

CAS712-50-5

Molecular FormulaC13H16O

Molecular Weight188.27

InChIInChI=1S/C13H16O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2

InChIKey BMFYCFSWWDXEPB-UHFFFAOYSA-N

SmilesC(C1CCCCC1)(C1=CC=CC=C1)=O


  •        ppm   Int.  Assign.
    203.71 202 1 136.40 319 2 132.69 469 3 128.57 1000 4 * 128.25 972 5 * 45.61 465 6 29.45 887 7 26.00 493 8 25.87 850 9
    Spectral Code: 13C NMR : in CDCl3


  •     Assign.     Shift(ppm)
    A 7.93 B 7.68 to 7.29 C 3.27 D 2.19 to 0.91
    Spectral Code: 1H NMR : 90 MHz in CDCl3

  • Spectral Code: IR : nujol mull

  • Spectral Code: Raman : 4880 A,200 M,powder

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