ALLYLCYCLOHEXANE(2114-42-3) IR1

Product NameALLYLCYCLOHEXANE

CAS 2114-42-3

Molecular FormulaC9H16

Molecular Weight124.22

InChIInChI=1S/C9H16/c1-2-6-9-7-4-3-5-8-9/h2,9H,1,3-8H2

InChIKey KVOZXXSUSRZIKD-UHFFFAOYSA-N

SmilesC1(CC=C)CCCCC1

Request For Quotation

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-6804          
allylcyclohexane
C9H16               (Mass of molecular ion:    124)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      27.0       8.8
      28.0       1.0
      29.0       7.1
      39.0      14.4
      40.0       2.1
      41.0      42.4
      42.0       2.3
      43.0       3.7
      51.0       1.9
      52.0       1.1
      53.0       6.1
      54.0       7.6
      55.0     100.0
      56.0       5.2
      65.0       1.8
      66.0       2.2
      67.0      22.0
      68.0       4.8
      69.0       1.8
      77.0       1.8
      79.0       3.0
      80.0       2.1
      81.0      10.6
      82.0      62.9
      83.0      98.3
      84.0       6.5
      95.0       2.1
      96.0       7.0
     124.0       6.4

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₉ H₁₆	0.05 ml : 0.5 ml CDCl₃
allylcyclohexane

    Assign.     Shift(ppm)

      A             5.778
      B             4.96
      C             4.95
      D             1.941
      E          1.73 to 1.660
      F             1.64
      G             1.30
      J             1.21
      K             1.15
      L             0.895

     Hz     ppm     Int.

   2330.20   5.831    151
   2323.12   5.813    302
   2319.95   5.805    161
   2315.92   5.795    180
   2312.74   5.787    362
   2306.15   5.771    390
   2303.10   5.763    203
   2298.95   5.753    180
   2295.90   5.745    355
   2288.70   5.727    179
   1995.24   4.993    198
   1993.77   4.989    371
   1992.92   4.987    384
   1992.43   4.986    359
   1991.46   4.984    580
   1989.99   4.980    341
   1984.99   4.967    307
   1983.89   4.965    564
   1982.67   4.962    497
   1981.57   4.959    414
   1980.47   4.956    263
   1978.39   4.951    168
   1976.93   4.947    256
   1976.07   4.945    404
   1974.61   4.941    913
   1973.51   4.939    872
   1972.41   4.936    658
   1971.19   4.933    328
   1970.09   4.930    170
    782.71   1.959    550
    781.62   1.956    412
    775.76   1.942   1000
    770.02   1.927    373
    768.80   1.924    600
    767.70   1.921    438
    688.72   1.724    469
    686.89   1.719    512
    685.30   1.715    568
    683.84   1.712    489
    682.25   1.708    575
    678.59   1.698    710
    677.25   1.695    685
    675.54   1.691    715
    674.19   1.687    706
    669.19   1.675    556
    665.28   1.665    422
    663.57   1.661    343
    662.48   1.658    349
    660.52   1.653    307
    659.18   1.650    240
    657.47   1.646    204
    656.01   1.642    178
    655.52   1.641    181
    653.20   1.635    189
    651.98   1.632    209
    650.15   1.627    234
    648.80   1.624    226
    647.22   1.620    184
    645.75   1.616    168
    540.16   1.352     37
    536.99   1.344     64
    533.57   1.336     90
    530.15   1.327    126
    529.17   1.325    116
    525.76   1.316    161
    522.34   1.307    205
    518.92   1.299    251
    515.63   1.291    201
    511.11   1.279    211
    507.57   1.271    236
    504.27   1.262    177
    500.98   1.254    141
    497.19   1.245    245
    495.24   1.240    260
    493.90   1.236    307
    491.09   1.229    227
    484.38   1.213    360
    481.32   1.205    469
    472.17   1.182    340
    469.36   1.175    521
    461.67   1.156    195
    459.11   1.149    302
    456.30   1.142    204
    452.51   1.133     62
    449.71   1.126    102
    446.78   1.118    216
    443.73   1.111    129
    437.74   1.096     48
    434.57   1.088     77
    431.27   1.080     49
    375.61   0.940    189
    372.68   0.933    220
    363.53   0.910    357
    360.60   0.903    460
    349.73   0.876    364
    339.72   0.851    131
    335.69   0.840    110

in CDCl3