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7144-05-0

4-氨甲基哌啶(7144-05-0)红外图谱(IR2)

产品名称:4-氨甲基哌啶

CAS:7144-05-0

分子式:C6H14N2

分子量: 114.19

InChI:InChI=1S/C6H14N2/c7-5-6-1-3-8-4-2-6/h6,8H,1-5,7H2

InChIKey: LTEKQAPRXFBRNN-UHFFFAOYSA-N

Smiles:N1CCC(CN)CC1

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    Mass

    MS-NW-1036          
    4-(aminomethyl)piperidine
    C6H14N2             (Mass of molecular ion:    114)
    

       Source Temperature: 250 °C
       Sample Temperature: 130 °C
       Reservoir, 75 eV
    

          15.0       2.3
          17.0       1.3
          18.0       6.4
          26.0       1.2
          27.0       9.4
          28.0      21.5
          29.0      14.0
          30.0      84.3
          31.0       2.3
          39.0       7.9
          40.0       1.5
          41.0      15.3
          42.0      24.3
          43.0      21.0
          44.0      10.0
          51.0       1.3
          52.0       1.4
          53.0       4.5
          54.0       7.2
          55.0      37.9
          56.0     100.0
          57.0      41.6
          58.0      13.9
          67.0       7.7
          68.0      11.7
          69.0      31.4
          70.0      10.6
          71.0       3.1
          79.0       1.5
          80.0       3.5
          81.0       2.9
          82.0      17.4
          83.0       2.5
          84.0      38.8
          85.0      28.9
          86.0      12.5
          94.0       1.4
          96.0      17.7
          97.0      14.4
          98.0       2.1
         114.0      28.3
         115.0       2.2
    

400 MHz in CDCl3

90 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H14 N2 0.05 ml : 0.5 ml CDCl3
    4-(aminomethyl)piperidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.079 B 2.585 C 2.556 D 1.707 E 1.41 F 1.36 G 1.088 J(A,B)=-11.7HZ J(A,G)=4.2HZ J(B,D)=2.7HZ J(B,G)=12.2HZ J(C,E)=6.6HZ J(E,G)=J(D,G)=12.2HZ

         Hz     ppm     Int.
    

       1240.60   3.105    159
       1239.75   3.103    164
       1236.57   3.095    263
       1235.47   3.092    173
       1233.40   3.087    176
       1228.03   3.073    192
       1227.42   3.072    190
       1224.85   3.065    289
       1221.92   3.058    181
       1220.95   3.056    181
       1047.49   2.622    262
       1044.80   2.615    259
       1041.50   2.607     37
       1035.28   2.591    437
       1032.59   2.584    429
       1024.90   2.565   1000
       1023.32   2.561    332
       1020.51   2.554    295
       1018.31   2.549    984
        690.80   1.729    180
        689.21   1.725    210
        688.23   1.723    200
        687.13   1.720    199
        683.35   1.710     84
        681.40   1.705     88
        678.59   1.698    182
        677.49   1.696    216
        676.64   1.694    224
        675.54   1.691    226
        673.95   1.687    207
        578.49   1.448     39
        575.56   1.441     48
        571.90   1.432     79
        570.68   1.428     65
        568.12   1.422     69
        566.89   1.419     99
        564.09   1.412    112
        560.30   1.402    171
        556.64   1.393    140
        555.30   1.390    137
        553.71   1.386    170
        545.41   1.365    581
        454.22   1.137    122
        450.07   1.127    118
        442.02   1.107    234
        437.87   1.096    242
        429.44   1.075    215
        426.15   1.067    183
        425.17   1.064    204
        417.36   1.045     88
        413.33   1.035     86
    

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    1H NMR 89.56 MHz
    C6 H14 N2 0.04 ml : 0.5 ml CDCl3
    4-(aminomethyl)piperidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.08 B 2.60 C 2.564 D 1.70 E 1.41 F 1.4 G 1.13

         Hz     ppm     Int.
    

        282.44   3.154     72
        273.94   3.059     75
        273.44   3.054     69
        273.06   3.049     68
        272.56   3.044     71
        271.00   3.026    102
        270.00   3.015    104
        268.25   2.996     79
        267.25   2.985     63
        244.44   2.730     86
        242.06   2.703     73
        232.13   2.592    460
        226.38   2.528    347
        220.88   2.467     68
        160.13   1.788     62
        159.81   1.785     64
        159.00   1.776     59
        158.38   1.769     61
        150.75   1.684     65
        149.56   1.670     58
        148.25   1.656     72
        147.06   1.643     84
        146.63   1.638     81
        145.50   1.625     69
        144.81   1.617     61
        126.00   1.407   1000
        122.88   1.373     71
        114.00   1.273     72
        113.63   1.269     72
        112.88   1.261     60
        110.06   1.229     65
        102.75   1.148     82
         98.56   1.101     76
    

in CDCl3

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CCl4 solution

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liquid film

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