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62439-35-4

p-cyanophenyl trans-4-pentylcyclohexanecarboxylate

Product Name p-cyanophenyl trans-4-pentylcyclohexanecarboxylate

CAS62439-35-4

MFC19H25NO2

MW299.41

  • 62439-35-4_ms_1
    Mass

    MS-NW-4499          
    p-cyanophenyl trans-4-pentylcyclohexanecarboxylate
    C19H25NO2           (Mass of molecular ion:    299)
    

       Source Temperature: 160 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          18.0       2.8
          27.0       6.7
          28.0       1.2
          29.0      12.2
          39.0       8.0
          40.0       1.4
          41.0      31.6
          42.0       2.4
          43.0      19.5
          51.0       1.1
          53.0       5.3
          54.0       9.2
          55.0      48.9
          56.0       3.3
          57.0      18.0
          63.0       1.7
          64.0       2.2
          65.0       1.5
          66.0       1.1
          67.0      20.9
          68.0       4.5
          69.0      40.0
          70.0       2.6
          71.0      22.5
          72.0       1.3
          77.0       1.6
          79.0       3.7
          80.0       1.3
          81.0      22.2
          82.0       5.6
          83.0      87.5
          84.0       6.0
          85.0       5.1
          90.0       3.7
          91.0       1.7
          95.0       8.5
          96.0       3.5
          97.0     100.0
          98.0       7.6
         102.0       2.1
         109.0       2.9
         111.0      25.5
         112.0       2.4
         118.0       1.4
         119.0       3.7
         120.0       2.0
         151.0       1.0
         153.0      60.1
         154.0       7.7
         181.0      61.5
         182.0       8.5
    

400 MHz in CDCl3

  • 62439-35-4_1hnmr_1

    1H NMR 399.65 MHz
    C19 H25 N O2 0.035 g : 0.5 ml CDCl3
    p-cyanophenyl trans-4-pentylcyclohexanecarboxylate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.678 B 7.209 C 2.491 D 2.126 E 1.886 F 1.542 G 1.37 to 1.19 J 1.21 K 0.982 L 0.890

         Hz     ppm     Int.
    

       3075.20   7.695    114
       3072.75   7.689    759
       3070.68   7.684    240
       3067.87   7.677     39
       3066.04   7.672    255
       3063.84   7.667    812
       3061.52   7.661    114
       2887.45   7.225    124
       2885.13   7.220    835
       2883.06   7.214    248
       2880.62   7.208     40
       2878.30   7.203    246
       2876.22   7.197    738
       2873.78   7.191    101
       1011.60   2.532     37
       1008.06   2.523     77
       1004.52   2.514     47
        999.39   2.501     82
        995.85   2.492    162
        992.31   2.483     87
        987.18   2.471     49
        983.64   2.462     86
        979.98   2.453     43
        858.03   2.147    122
        856.57   2.144    120
        854.74   2.139    125
        854.49   2.139    125
        853.27   2.136    104
        849.49   2.126     70
        844.36   2.113    137
        843.87   2.112    135
        842.29   2.108    126
        840.94   2.105    130
        760.74   1.904    127
        760.01   1.902    126
        759.77   1.902    126
        758.18   1.898    136
        753.05   1.885     58
        747.44   1.871    137
        747.19   1.870    137
        744.26   1.863    130
        636.96   1.594     61
        633.42   1.585     57
        623.78   1.561    161
        620.24   1.552    144
        611.45   1.530    149
        607.79   1.521    142
        598.14   1.497     57
        594.73   1.489     51
        540.41   1.353     41
        539.43   1.350     36
        537.35   1.345     57
        537.11   1.344     57
        533.20   1.335    116
        530.88   1.329    114
        526.86   1.319    216
        525.63   1.316    222
        520.39   1.303    293
        519.17   1.300    286
        518.68   1.298    285
        513.55   1.285    303
        512.45   1.283    306
        509.64   1.276    289
        507.69   1.271    285
        505.74   1.266    240
        504.03   1.262    245
        499.88   1.251    176
        497.44   1.245    183
        491.82   1.231    219
        489.62   1.226    192
        487.30   1.220    175
        485.11   1.214    179
        478.15   1.197    115
        472.41   1.183     45
        470.21   1.177     34
        469.97   1.176     34
        412.23   1.032     67
        408.94   1.024     68
        399.05   0.999    148
        395.63   0.990    126
        392.09   0.982     30
        387.82   0.971    111
        384.77   0.963    121
        374.39   0.937     60
        371.22   0.929     58
        369.02   0.924     34
        367.19   0.919     48
        363.04   0.909    344
        356.08   0.891   1000
        353.64   0.885     86
        348.88   0.873    390
    

in CDCl3

  • 62439-35-4_13cnmr_1

KBr disc

  • 62439-35-4_ir1_1