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ISOPROPYLCYCLOHEXANE

Product Name ISOPROPYLCYCLOHEXANE

CAS696-29-7

MFC9H18

MW126.24

¹³CNMR

Mass

MS-NW-3641          
isopropylcyclohexane
C9H18               (Mass of molecular ion:    126)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      27.0      11.7
      29.0       9.0
      39.0      11.8
      40.0       1.8
      41.0      41.0
      42.0       6.9
      43.0      12.9
      51.0       1.4
      53.0       4.6
      54.0       8.6
      55.0      89.9
      56.0      10.1
      57.0       3.5
      67.0      27.7
      68.0       2.7
      69.0      17.5
      70.0       1.9
      77.0       1.0
      79.0       1.3
      81.0       3.5
      82.0      79.2
      83.0     100.0
      84.0       7.4
     111.0       2.0
     126.0      10.1
     127.0       1.1

90 MHz in CDCl3

400 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₈	0.04 ml : 0.5 ml CDCl₃
isopropylcyclohexane

    Assign.     Shift(ppm)

      A          1.88 to 1.50
      B          1.50 to 0.90
      C             0.853

     Hz     ppm     Int.

    153.31   1.712    140
    151.44   1.691    143
    147.94   1.652    128
    146.00   1.631    101
    141.94   1.585     63
    138.06   1.542     37
    137.31   1.534     36
    136.75   1.527     35
    135.69   1.516     33
    134.88   1.507     32
    134.00   1.497     31
    133.69   1.493     30
    133.25   1.488     30
    132.69   1.482     30
    132.19   1.476     30
    130.06   1.453     32
    127.63   1.426     39
    127.25   1.421     38
    126.69   1.415     37
    125.75   1.405     35
    124.81   1.394     33
    124.44   1.390     33
    124.06   1.386     34
    123.75   1.382     35
    123.00   1.374     34
    120.06   1.341     39
    118.81   1.327     45
    117.56   1.313     44
    116.63   1.303     47
    115.38   1.289     41
    113.50   1.268     36
    112.94   1.262     35
    110.00   1.229     48
    109.69   1.225     48
    105.25   1.176     75
    104.94   1.172     75
    103.94   1.161     75
    103.44   1.155     75
    102.75   1.148     75
    102.44   1.144     75
    101.19   1.130     69
     96.25   1.075    102
     94.31   1.054     92
     92.75   1.036     88
     90.88   1.015    114
     89.56   1.000    103
     88.00   0.983     89
     87.56   0.978     88
     87.13   0.973     88
     82.63   0.923     53
     81.81   0.914     54
     78.81   0.880   1000
     72.56   0.811    618

¹H NMR	399.65 MHz
C₉ H₁₈	0.04 ml : 0.5 ml CDCl₃
isopropylcyclohexane

    Assign.     Shift(ppm)

      A          1.77 to 1.60
      B             1.393
      C             1.19
      D             1.14
      E             1.03
      F             0.94
      G             0.847

     Hz     ppm     Int.

    698.24   1.748     39
    697.02   1.745     32
    694.58   1.738     58
    691.65   1.731     46
    688.11   1.722     31
    685.30   1.715     45
    682.25   1.708     63
    680.54   1.703     55
    678.71   1.699     58
    675.42   1.691     51
    673.83   1.687     59
    671.63   1.681     55
    670.65   1.679     49
    668.09   1.672     30
    662.35   1.658     76
    661.13   1.655     93
    659.18   1.650     76
    658.57   1.648     75
    657.23   1.645     62
    655.15   1.640     42
    650.39   1.628     33
    649.05   1.625     31
    566.77   1.419     35
    561.52   1.406     35
    559.94   1.402     49
    554.81   1.389     45
    553.10   1.384     41
    547.97   1.372     35
    490.23   1.227     31
    489.62   1.226     31
    487.43   1.220     45
    477.17   1.194     42
    474.73   1.188     67
    472.53   1.183     38
    464.97   1.164     34
    461.67   1.156     52
    460.82   1.154     48
    458.50   1.148     30
    449.58   1.125     44
    437.01   1.094     33
    404.42   1.012     41
    401.73   1.006     39
    399.29   1.000     38
    391.85   0.981     37
    389.77   0.976     39
    388.92   0.974     34
    380.98   0.954     57
    377.93   0.946     64
    368.16   0.922     39
    364.99   0.914     42
    342.04   0.856   1000
    339.72   0.851     43
    335.21   0.839    903

in CDCl3

liquid film

4880 A,200 M,liquid

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