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13214-66-9

4-苯基丁胺(13214-66-9)核磁图(1HNMR)

产品名称:4-苯基丁胺

CAS:13214-66-9

分子式:C10H15N

分子量: 149.23

InChI:InChI=1S/C10H15N/c11-9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,11H2

InChIKey: AGNFWIZBEATIAK-UHFFFAOYSA-N

Smiles:C1(CCCCN)=CC=CC=C1

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    Mass

    MS-NW-5567          
    4-phenylbutylamine
    C10H15N             (Mass of molecular ion:    149)
    

       Source Temperature: 250 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       3.1
          27.0       1.6
          28.0       2.8
          30.0     100.0
          31.0       2.1
          39.0       3.5
          41.0       2.1
          42.0       1.0
          43.0       4.0
          44.0       1.7
          45.0      29.5
          51.0       2.7
          56.0       2.5
          63.0       1.5
          65.0       5.4
          77.0       3.0
          78.0       1.7
          79.0       1.2
          89.0       1.0
          91.0      14.5
          92.0       1.8
         103.0       1.5
         104.0      12.2
         105.0       2.5
         106.0       1.8
         115.0       1.2
         117.0       2.3
         131.0       1.9
         132.0       3.9
         149.0      15.8
         150.0       1.9
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C10 H15 N 0.04 ml : 0.5 ml CDCl3
    4-phenylbutylamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.27 to 7.11 B 2.68 C 2.64 D 1.67 to 1.45 E 1.29

         Hz     ppm     Int.
    

        658.69   7.355     92
        656.06   7.326     47
        655.44   7.319     46
        653.44   7.297     74
        651.13   7.271    191
        649.25   7.250    213
        648.19   7.238    202
        646.19   7.216    979
        644.88   7.201   1000
        641.13   7.159    160
        640.63   7.154    141
        639.31   7.139     96
        638.56   7.130    118
        637.88   7.123     85
        637.38   7.117    102
        637.06   7.114    107
        635.88   7.101     53
        632.13   7.059     47
        248.44   2.775    174
        241.88   2.701    435
        235.06   2.625    438
        231.13   2.581     64
        230.56   2.575     51
        227.69   2.543    233
        157.56   1.760     65
        155.63   1.738     46
        154.44   1.725     56
        152.88   1.708     72
        149.75   1.673    109
        148.81   1.662     95
        147.88   1.652     91
        147.00   1.642     88
        145.38   1.624    135
        144.94   1.619    131
        143.44   1.602    208
        142.56   1.592    194
        142.06   1.587    194
        141.63   1.582    200
        139.38   1.557    318
        138.25   1.544    177
        136.56   1.525    270
        134.75   1.505    144
        133.25   1.488     85
        132.44   1.479    105
        131.75   1.472    120
        130.69   1.460    134
        129.94   1.451    112
        129.31   1.444     99
        127.56   1.425     72
        125.38   1.400     72
        124.94   1.396     75
        122.38   1.367     56
        121.44   1.356     57
        121.06   1.352     52
        115.81   1.294    701
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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