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网站主页CAS数据库列表 5414-21-1更多图谱5-溴戊腈(5414-21-1)核磁图(13CNMR)

5-溴戊腈

产品名称 5-溴戊腈

CAS号5414-21-1

分子式C5H8BrN

分子量162.03

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  • Mass

    MS-IW-3657          
    5-bromovaleronitrile
    C5H8BrN             (Mass of molecular ion:    161)
    

       Source Temperature: 220 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          26.0       3.9
          27.0      16.7
          28.0       8.4
          29.0      10.8
          37.0       1.2
          38.0       2.5
          39.0      17.2
          40.0       3.1
          41.0      43.7
          42.0       3.1
          50.0       1.4
          51.0       2.8
          52.0       4.0
          53.0       7.7
          54.0     100.0
          55.0      84.8
          56.0       4.0
          59.0       1.3
          66.0       2.0
          68.0       2.8
          80.0       3.0
          81.0       1.0
          82.0      47.5
          83.0       3.0
          93.0       2.9
          95.0       2.7
         107.0       4.3
         109.0       3.8
         121.0       1.8
         123.0       1.0
         133.0       3.0
         135.0       3.8
         161.0       8.7
         163.0       8.4
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C5 H8 Br N 0.05 ml : 0.5 ml CDCl3
    5-bromovaleronitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.457 B 2.419 C 2.016 D 1.838

         Hz     ppm     Int.
    

       1387.94   3.473    633
       1385.38   3.467     43
       1381.59   3.458    967
       1375.12   3.441    614
        977.66   2.447     35
        974.00   2.438    567
        971.31   2.431     44
        966.92   2.420   1000
        959.84   2.402    622
        820.43   2.053    100
        814.21   2.038    218
        813.23   2.035    252
        810.18   2.028    108
        807.01   2.020    275
        806.03   2.017    226
        805.05   2.015    197
        803.83   2.012    193
        800.54   2.004    141
        799.68   2.001    142
        798.58   1.999    344
        792.24   1.983    154
        749.15   1.875    135
        748.41   1.873    139
        743.29   1.860    111
        741.46   1.856    319
        736.33   1.843    155
        734.01   1.837    313
        729.61   1.826     91
        729.13   1.825     89
        726.81   1.819    228
        726.20   1.818    249
        719.73   1.801     75
        718.87   1.799     81
    

in CDCl3



liquid film