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626-87-9

1,4-二溴戊烷(626-87-9)核磁图(1HNMR)

产品名称:1,4-二溴戊烷

CAS:626-87-9

分子式:C5H10Br2

分子量: 229.94

InChI:InChI=1S/C5H10Br2/c1-5(7)3-2-4-6/h5H,2-4H2,1H3

InChIKey: CNBFRBXEGGRSPL-UHFFFAOYSA-N

Smiles:C(Br)CCC(Br)C

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    Mass

    MS-NW-1055          
    1,4-dibromopentane
    C5H10Br2            (Mass of molecular ion:    228)
    

       Source Temperature: 240 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          18.0       1.4
          26.0       1.8
          27.0      16.8
          29.0       6.2
          38.0       1.5
          39.0      12.8
          40.0       2.4
          41.0      62.1
          42.0       8.1
          43.0      11.8
          53.0       4.0
          55.0       5.1
          67.0       2.4
          68.0       1.1
          69.0     100.0
          70.0       5.8
         107.0       6.4
         109.0       6.0
         121.0       1.0
         149.0      30.9
         150.0       2.5
         151.0      29.3
         152.0       1.7
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C5 H10 Br2 0.02 ml : 0.5 ml CDCl3
    1,4-dibromopentane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.15 B 3.44 C 2.22 to 1.72 D 1.739

         Hz     ppm     Int.
    

        314.88   3.516     69
        314.50   3.512     77
        310.38   3.466     80
        309.69   3.458    107
        308.44   3.444    264
        303.13   3.385     88
        302.38   3.377    109
        183.88   2.054     82
        182.25   2.035    138
        181.00   2.021    153
        179.44   2.004    154
        178.56   1.994    138
        178.06   1.989    156
        177.25   1.980    167
        176.44   1.971    173
        175.31   1.958    117
        174.38   1.948     88
        173.25   1.935     77
        171.44   1.915     78
        170.88   1.908    104
        159.00   1.776   1000
        152.31   1.701    931
    

in CDCl3

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CCl4 solution

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liquid film

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4880 A,200 M,liquid

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