1-CYANO-4-(4-PROPYLCYCLOHEXYL)BENZENE(62788-03-8) MS

Mass

MS-NW-4500          
p-(4-propylcyclohexyl)benzonitrile
C16H21N             (Mass of molecular ion:    227)

   Source Temperature: 240 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      27.0      13.5
      29.0      14.7
      39.0      16.4
      40.0       2.4
      41.0      42.2
      42.0       5.6
      43.0      32.9
      44.0       1.2
      50.0       1.9
      51.0       4.6
      52.0       2.0
      53.0       6.3
      54.0       8.3
      55.0      54.8
      56.0      15.3
      57.0       6.4
      63.0       3.6
      64.0       1.4
      65.0       2.7
      66.0       1.8
      67.0      18.7
      68.0       6.5
      69.0      28.6
      70.0      28.4
      71.0       1.8
      75.0       2.4
      76.0       2.9
      77.0       6.0
      78.0       2.6
      79.0       3.5
      80.0       3.3
      81.0      36.8
      82.0      48.6
      83.0      12.1
      84.0       5.0
      85.0       7.7
      88.0       1.0
      89.0       8.8
      90.0       2.8
      91.0       2.0
      95.0       9.5
      96.0       8.4
      97.0       3.2
      98.0      30.3
      99.0       2.4
     101.0       2.9
     102.0       6.7
     103.0       8.4
     104.0      10.7
     105.0       1.2
     107.0       1.8
     109.0       9.2
     110.0       2.3
     111.0       4.7
     113.0       1.0
     114.0       1.7
     115.0      12.6
     116.0      87.0
     117.0      23.1
     118.0       2.8
     121.0       2.4
     122.0      35.5
     123.0       7.1
     124.0      10.5
     125.0       1.0
     127.0       3.6
     128.0       9.6
     129.0     100.0
     130.0      59.3
     131.0      11.9
     132.0       1.1
     140.0       7.9
     141.0       3.6
     142.0      46.7
     143.0      46.6
     144.0      14.0
     145.0      10.7
     146.0       1.3
     153.0       2.0
     154.0       3.5
     155.0       2.6
     156.0       7.5
     157.0       5.7
     158.0       2.2
     166.0       1.0
     167.0       4.7
     168.0       3.0
     170.0       3.7
     171.0       1.7
     172.0       1.2
     182.0       1.5
     183.0       2.8
     184.0      23.0
     185.0       7.3
     186.0       1.5
     198.0       4.9
     199.0       3.5
     212.0       1.3
     226.0       3.0
     227.0      93.3
     228.0      16.8
     229.0       1.6

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₆ H₂₁ N	0.031 g : 0.5 ml CDCl₃
p-(4-propylcyclohexyl)benzonitrile

    Assign.     Shift(ppm)

      A             7.565
      B             7.299
      C             2.518
      D             1.88
      E             1.43
      F             1.34
      G             1.29
      J             1.220
      K             1.053
      L             0.902

     Hz     ppm     Int.

   3029.54   7.581     75
   3027.83   7.577    427
   3026.00   7.572    153
   3021.24   7.560    170
   3019.41   7.556    509
   3017.58   7.551     91
   2922.97   7.314     78
   2922.49   7.313     85
   2920.78   7.309    470
   2919.31   7.305    141
   2918.82   7.304    129
   2916.50   7.298     36
   2914.67   7.294    129
   2914.18   7.292    136
   2912.72   7.289    410
   2912.23   7.287    314
   2911.01   7.284     72
   2910.52   7.283     67
   1019.41   2.551     39
   1019.17   2.551     39
   1009.89   2.527     45
   1006.96   2.520     81
   1003.78   2.512     49
    994.63   2.489     43
    760.01   1.902    133
    756.71   1.894    234
    755.62   1.891    213
    745.61   1.866    233
    744.26   1.863    232
    740.97   1.855    133
    592.53   1.483     33
    590.21   1.477     52
    580.32   1.453     97
    577.64   1.446    111
    567.99   1.422    124
    564.94   1.414    102
    557.74   1.396     36
    555.30   1.390     59
    552.25   1.382     56
    550.29   1.377     82
    549.07   1.374     76
    546.26   1.367     40
    543.09   1.359    132
    541.75   1.356    149
    539.06   1.349     76
    535.89   1.341    132
    534.55   1.338    196
    531.62   1.331     86
    527.47   1.320    152
    524.54   1.313     65
    520.63   1.303     76
    519.65   1.301     66
    517.09   1.294     42
    516.72   1.293     42
    515.01   1.289     55
    512.08   1.282     40
    510.25   1.277     34
    509.28   1.275     37
    506.96   1.269     35
    503.78   1.261     39
    500.98   1.254     31
    497.07   1.244    151
    495.85   1.241    143
    494.26   1.237     37
    493.77   1.236     38
    491.82   1.231    132
    489.99   1.227    140
    488.65   1.223    137
    487.30   1.220    130
    485.23   1.215     88
    482.67   1.208     80
    480.96   1.204    164
    475.59   1.191     49
    473.75   1.186     50
    439.82   1.101     53
    436.89   1.094     62
    427.25   1.070    110
    425.17   1.064    103
    424.07   1.062    115
    414.18   1.037     98
    410.40   1.027     49
    402.59   1.008     40
    371.34   0.930     41
    367.55   0.920    543
    365.36   0.915     51
    360.35   0.902   1000
    353.03   0.884    421

in CDCl3

KBr disc