4'-CYCLOHEXYLACETOPHENONE(18594-05-3) IR1

Product Name4'-CYCLOHEXYLACETOPHENONE

CAS 18594-05-3

Molecular FormulaC14H18O

Molecular Weight202.29

InChIInChI=1S/C14H18O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3

InChIKey MSDQNIRGPBARGC-UHFFFAOYSA-N

SmilesC(=O)(C1=CC=C(C2CCCCC2)C=C1)C

Request For Quotation

Mass

MS-IW-2158          
4'-cyclohexylacetophenone
C14H18O             (Mass of molecular ion:    202)

   Source Temperature: 210 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      39.0       1.7
      41.0       2.5
      43.0      15.5
      51.0       1.4
      55.0       1.5
      63.0       1.0
      65.0       1.1
      67.0       1.2
      77.0       4.1
      79.0       1.0
      81.0       1.3
      89.0       1.0
      90.0       1.5
      91.0       9.7
     102.0       1.0
     103.0       3.2
     105.0       3.6
     115.0       4.0
     116.0       1.3
     117.0       3.2
     118.0       1.2
     128.0       1.3
     129.0       1.4
     131.0       8.8
     133.0       1.8
     134.0       1.3
     145.0       1.3
     146.0       1.7
     159.0       2.3
     187.0     100.0
     188.0      14.5
     189.0       1.2
     202.0      22.4
     203.0       3.5

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₄ H₁₈ O	0.036 g : 0.5 ml CDCl₃
4'-cyclohexylacetophenone

    Assign.     Shift(ppm)

      A             7.890
      B             7.293
      C             2.574
      D             2.56
      E          1.90 to 1.83
      F             1.764
      G          1.47 to 1.36
      J             1.266

     Hz     ppm     Int.

   3157.71   7.902    160
   3155.76   7.897     55
   3151.12   7.885     58
   3149.17   7.880    180
   2918.58   7.303    153
   2916.99   7.299     49
   2911.99   7.287     47
   2910.40   7.283    150
   1028.69   2.574   1000
    753.66   1.886     30
    750.61   1.879     55
    747.56   1.871     73
    744.26   1.863     82
    742.68   1.859     75
    741.21   1.855     78
    734.50   1.838     31
    578.61   1.448     30
    569.82   1.426     64
    566.53   1.418     59
    560.79   1.404     63
    551.51   1.380     34

in CDCl3