4-(4-Butylcyclohexyl)benzonitrile(62788-04-9) MS

Mass

MS-NW-4505          
p-(4-butylcyclohexyl)benzonitrile
C17H23N             (Mass of molecular ion:    241)

   Source Temperature: 240 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV

      18.0       2.1
      27.0      15.4
      28.0       1.1
      29.0      23.8
      39.0      16.3
      40.0       2.4
      41.0      45.7
      42.0       6.1
      43.0      18.6
      50.0       1.6
      51.0       3.9
      52.0       1.9
      53.0       6.8
      54.0       9.1
      55.0      65.5
      56.0      15.6
      57.0      36.7
      58.0       1.6
      63.0       3.0
      64.0       1.2
      65.0       2.7
      66.0       2.0
      67.0      22.2
      68.0       7.6
      69.0      22.5
      70.0      39.8
      71.0       4.6
      75.0       1.9
      76.0       2.5
      77.0       6.1
      78.0       2.9
      79.0       4.0
      80.0       3.6
      81.0      37.8
      82.0      25.5
      83.0      16.0
      84.0       5.8
      89.0       8.0
      90.0       2.5
      91.0       2.1
      94.0       2.2
      95.0       8.1
      96.0      54.3
      97.0      10.1
      98.0       3.1
     101.0       2.6
     102.0       6.2
     103.0       8.2
     104.0      10.4
     105.0       1.2
     107.0       2.2
     109.0       4.8
     110.0       3.6
     111.0       1.5
     112.0      17.4
     113.0       1.6
     114.0       1.4
     115.0      12.3
     116.0      88.4
     117.0      22.6
     118.0       2.8
     123.0       6.5
     124.0       1.7
     125.0       1.6
     127.0       3.4
     128.0       8.8
     129.0     100.0
     130.0      64.2
     131.0      12.0
     132.0       1.2
     135.0       2.9
     136.0      43.3
     137.0       7.7
     138.0       8.3
     139.0       1.1
     140.0       7.3
     141.0       3.6
     142.0      49.1
     143.0      44.6
     144.0      13.8
     145.0      10.8
     146.0       1.3
     153.0       1.9
     154.0       3.9
     155.0       3.4
     156.0       8.0
     157.0       6.2
     158.0       3.0
     166.0       1.0
     167.0       5.1
     168.0       3.8
     169.0       1.0
     170.0       4.1
     171.0       1.5
     172.0       1.1
     182.0       1.9
     183.0       3.9
     184.0      26.2
     185.0       8.2
     186.0       1.9
     198.0       4.5
     199.0       3.7
     200.0       1.1
     212.0       4.2
     213.0       2.4
     240.0       2.7
     241.0      90.2
     242.0      17.2
     243.0       1.6

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₇ H₂₃ N	0.040 g : 0.5 ml CDCl₃
p-(4-butylcyclohexyl)benzonitrile

    Assign.     Shift(ppm)

      A             7.564
      B             7.299
      C             2.519
      D             1.88
      E             1.430
      F          1.33 to 1.24
      G             1.23
      J             1.056
      K             0.903

     Hz     ppm     Int.

   3029.17   7.580    122
   3027.47   7.576    681
   3025.63   7.571    255
   3020.87   7.559    264
   3019.04   7.555    801
   3017.33   7.550    150
   2922.49   7.313    136
   2920.78   7.309    731
   2919.31   7.305    243
   2916.63   7.298     57
   2914.18   7.292    210
   2912.72   7.289    630
   1022.22   2.558     37
   1021.85   2.557     37
   1019.17   2.551     69
   1015.87   2.542     47
   1010.01   2.528     78
   1006.84   2.520    142
   1003.78   2.512     83
    997.68   2.497     47
    994.63   2.489     74
    991.58   2.482     40
    756.96   1.895    353
    746.58   1.869    366
    745.61   1.866    365
    741.09   1.855    197
    593.38   1.485     51
    591.80   1.481     45
    589.11   1.475     81
    579.47   1.450    170
    576.42   1.443    175
    572.27   1.432     41
    571.78   1.431     40
    571.41   1.430     40
    567.14   1.420    203
    563.96   1.412    175
    554.20   1.387     82
    551.39   1.380     77
    537.60   1.346     39
    529.91   1.326    146
    526.49   1.318    313
    522.46   1.308    466
    520.51   1.303    383
    518.19   1.297    499
    515.50   1.290    462
    511.84   1.281    286
    506.23   1.267    177
    500.49   1.253    230
    498.17   1.247    226
    495.24   1.240    271
    492.43   1.233    161
    490.23   1.227    126
    489.38   1.225    129
    488.77   1.223    128
    482.30   1.207     49
    439.82   1.101     81
    437.01   1.094     89
    433.84   1.086     40
    433.47   1.085     40
    432.74   1.083     41
    427.37   1.070    171
    424.32   1.062    162
    414.18   1.037    147
    403.32   1.010     55
    403.08   1.009     55
    400.39   1.002     34
    399.54   1.000     35
    399.17   0.999     34
    375.24   0.939     32
    367.43   0.920    339
    365.97   0.916    209
    360.60   0.903   1000
    358.15   0.897    222
    356.57   0.893    180
    354.98   0.889    175
    353.39   0.885    264

in CDCl3

KBr disc