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629-50-5

十三烷(629-50-5)核磁图(13CNMR)

产品名称:十三烷

CAS:629-50-5

分子式:C13H28

分子量: 184.36

InChI:InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3

InChIKey: IIYFAKIEWZDVMP-UHFFFAOYSA-N

Smiles:CCCCCCCCCCCCC

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    Mass

    MS-NW-5091          
    tridecane
    C13H28              (Mass of molecular ion:    184)
    

       Source Temperature: 270 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          27.0       8.0
          28.0       1.1
          29.0      16.8
          39.0       4.1
          41.0      25.2
          42.0       8.8
          43.0      82.3
          44.0       2.9
          53.0       1.2
          54.0       1.1
          55.0      11.8
          56.0      13.0
          57.0     100.0
          58.0       4.7
          69.0       5.5
          70.0      10.5
          71.0      54.8
          72.0       3.2
          83.0       2.7
          84.0       6.0
          85.0      31.8
          86.0       2.4
          97.0       1.4
          98.0       4.2
          99.0       5.8
         112.0       2.5
         113.0       3.7
         126.0       1.6
         127.0       3.1
         141.0       2.0
         155.0       1.1
         184.0       2.2
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C13 H28 0.04 ml : 0.5 ml CDCl3
    tridecane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 1.26 B 0.89

         Hz     ppm     Int.
    

        112.88   1.261   1000
         83.81   0.936     41
         78.75   0.880    117
         72.63   0.811     28
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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