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网站主页CAS数据库列表 544-10-5更多图谱1-氯己烷(544-10-5)核磁图(13CNMR)

1-氯己烷

产品名称 1-氯己烷

CAS号544-10-5

分子式C6H13Cl

分子量120.62

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  • Mass

    MS-NW-1039          
    1-chlorohexane
    C6H13Cl             (Mass of molecular ion:    120)
    

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

          15.0       1.3
          18.0       3.2
          26.0       2.2
          27.0      27.0
          28.0       5.0
          29.0      32.0
          31.0       1.4
          38.0       1.2
          39.0      16.7
          40.0       2.9
          41.0      59.0
          42.0      44.7
          43.0      72.0
          44.0       2.5
          49.0       3.0
          51.0       1.4
          53.0       3.7
          54.0       3.9
          55.0      81.1
          56.0      56.5
          57.0      14.7
          62.0       1.2
          63.0       4.7
          65.0       1.5
          67.0       2.7
          69.0      22.1
          70.0       2.1
          71.0       2.8
          82.0       1.2
          83.0       1.3
          84.0       4.2
          91.0     100.0
          92.0       4.5
          93.0      32.0
          94.0       1.4
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C6 H13 Cl 0.04 ml : 0.5 ml CDCl3
    1-chlorohexane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.533 B 1.78 C 1.56 to 1.14 D 0.90

         Hz     ppm     Int.
    

        326.25   3.643     38
        322.94   3.606    387
        320.00   3.574     52
        319.00   3.562     47
        316.44   3.534   1000
        309.75   3.459    594
        165.69   1.851     89
        158.94   1.775    161
        152.63   1.705    147
        121.63   1.359    458
        119.50   1.335    598
        117.88   1.317    612
         86.06   0.961    233
         82.44   0.921    190
         80.50   0.899    903
         73.75   0.824    154
    

in CDCl3



CCl4 solution



liquid film



4880 A,200 M,liquid