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Chlorocyclohexane

CAS542-18-7

MFC6H11Cl

MW118.6

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  • Mass

    MS-NW-1285          
    chlorocyclohexane
    C6H11Cl             (Mass of molecular ion:    118)
    

       Source Temperature: 260 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       1.1
          26.0       2.0
          27.0      15.7
          28.0       4.6
          29.0       6.6
          32.0       1.0
          38.0       1.6
          39.0      19.1
          40.0       4.0
          41.0      43.7
          42.0       6.3
          43.0       3.5
          49.0       1.3
          50.0       1.9
          51.0       3.3
          52.0       1.5
          53.0       7.8
          54.0      33.5
          55.0      41.6
          56.0       9.8
          62.0       2.5
          65.0       1.4
          66.0       1.5
          67.0     100.0
          68.0       6.1
          69.0       5.0
          75.0       2.6
          77.0       1.7
          79.0       2.5
          81.0       9.1
          82.0      71.1
          83.0      29.3
          84.0       1.7
         118.0       2.0
    

90 MHz in CDCl3

400 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C6 H11 Cl 0.04 ml : 0.5 ml CDCl3
    chlorocyclohexane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.01 B 2.29 to 1.12

         Hz     ppm     Int.
    

        373.19   4.167     42
        371.19   4.145    144
        370.56   4.138    108
        369.25   4.123     84
        367.50   4.104    239
        365.50   4.082    134
        364.81   4.074    145
        363.19   4.056    274
        362.25   4.045    316
        361.00   4.031    190
        358.56   4.004    478
        354.81   3.962    351
        351.56   3.926    134
        349.75   3.906    229
        347.44   3.880     80
        346.75   3.872    116
        346.00   3.864    137
        205.44   2.294     48
        204.44   2.283     45
        204.06   2.279     54
        203.38   2.271     56
        202.00   2.256     76
        200.94   2.244     95
        200.44   2.239     98
        199.88   2.232    107
        199.50   2.228    109
        199.13   2.224    106
        197.69   2.208    130
        196.06   2.190    204
        194.81   2.176    243
        192.63   2.151    365
        191.31   2.137    441
        186.25   2.080    524
        184.25   2.058    469
        182.69   2.040    478
        181.50   2.027    516
        179.38   2.003    787
        176.00   1.966    477
        175.63   1.962    496
        175.31   1.958    496
        174.50   1.949    468
        172.31   1.924    328
        171.94   1.920    333
        171.19   1.912    324
        169.69   1.895    339
        169.06   1.888    367
        167.06   1.866    500
        164.06   1.832    775
        162.81   1.818    722
        160.44   1.792    776
        159.94   1.786    763
        158.88   1.775    714
        155.31   1.735    852
        152.81   1.707    793
        151.50   1.692    720
        150.50   1.681    655
        149.06   1.665    614
        146.75   1.639    740
        145.31   1.623    677
        143.94   1.608    792
        143.31   1.601    821
        142.50   1.592    724
        141.56   1.581    706
        140.75   1.572    752
        139.25   1.555    559
        138.94   1.552    556
        138.13   1.543    593
        137.06   1.531    553
        136.69   1.527    552
        133.88   1.495    721
        132.63   1.481    802
        130.94   1.463    796
        128.31   1.433   1000
        125.69   1.404    777
        124.50   1.391    752
        123.25   1.377    672
        120.56   1.347    915
        118.75   1.326    848
        117.06   1.308    628
        115.63   1.292    524
        113.88   1.272    481
        111.81   1.249    408
        111.50   1.245    415
        109.81   1.227    284
        108.00   1.206    227
        105.06   1.174    142
        104.06   1.162    117
        102.75   1.148     90
        100.94   1.128     72
        100.63   1.124     79
         99.75   1.114     61
         99.13   1.107     54
         98.44   1.100     43
         97.75   1.092     50
         97.19   1.086     57
         96.88   1.082     50
         96.50   1.078     43
    


  • 1H NMR 399.65 MHz
    C6 H11 Cl 0.05 ml : 0.5 ml CDCl3
    chlorocyclohexane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.003 B 2.062 C 1.80 D 1.660 E 1.54 F 1.36 G 1.30 ASSIGNED BY H-H COSY. J(A,B)=4.0HZ J(A,D)=9.6HZ J(C,D)=3.6HZ

         Hz     ppm     Int.
    

       1613.40   4.038    158
       1609.50   4.028    291
       1604.00   4.014    342
       1600.10   4.004    545
       1596.19   3.994    345
       1590.70   3.981    286
       1586.91   3.971    159
        833.74   2.087    520
        830.44   2.078    563
        825.32   2.066    503
        824.46   2.063    504
        820.43   2.053    608
        819.34   2.051    636
        816.28   2.043    614
        738.16   1.848     34
        733.03   1.835    192
        729.00   1.825    340
        726.56   1.818    422
        724.49   1.813    455
        723.51   1.811    442
        720.21   1.803    583
        714.72   1.789    728
        710.08   1.777    652
        706.42   1.768    324
        704.96   1.764    297
        700.20   1.753     81
        697.02   1.745     81
        693.73   1.736     60
        691.53   1.731     54
        688.11   1.722     49
        685.30   1.715     66
        681.40   1.705    264
        677.61   1.696    298
        671.39   1.680    515
        668.09   1.672    725
        664.79   1.664    435
        661.87   1.657    388
        658.57   1.648    675
        655.03   1.640    563
        648.93   1.624    251
        645.39   1.615    298
        639.28   1.600     43
        639.04   1.599     43
        635.25   1.590     48
        632.57   1.583     40
        629.15   1.575     64
        619.87   1.552    326
        617.31   1.545    386
        611.57   1.531    352
        609.25   1.525    252
        607.67   1.521    261
        606.45   1.518    239
        603.15   1.510    203
        599.98   1.502    137
        596.31   1.493     48
        562.74   1.409    209
        559.45   1.400    234
        552.49   1.383    491
        549.07   1.374    679
        545.53   1.366    405
        542.11   1.357    456
        539.06   1.349    908
        536.01   1.342   1000
        531.74   1.331    633
        530.52   1.328    627
        528.56   1.323    571
        527.22   1.320    626
        525.51   1.315    613
        517.70   1.296    137
        515.26   1.290    220
        512.21   1.282    140
        505.25   1.265     72
        502.08   1.257     51
    

in CDCl3



CCl4 solution



liquid film



4880 A,200 M,liquid