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网站主页CAS数据库列表 111-87-5更多图谱辛醇(111-87-5)质谱(MS)

辛醇

产品名称 辛醇

CAS号111-87-5

分子式C8H18O

分子量130.23

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  • Mass

    MS2014-05097CW      
    1-octanol
    C8H18O              (Mass of molecular ion:    130)
    

       Source Temperature: 250 °C
       Sample Temperature: 250 °C
       Reservoir, 70 eV
    

          14.0       1.1
          18.0       1.0
          26.0       1.1
          27.0      18.8
          28.0       4.4
          29.0      24.4
          31.0      25.3
          32.0       3.3
          39.0      18.6
          40.0       4.0
          41.0      74.3
          42.0      44.1
          43.0      59.1
          44.0       5.0
          45.0       4.0
          51.0       1.3
          53.0       5.7
          54.0       6.4
          55.0      91.0
          56.0     100.0
          57.0      40.8
          58.0       2.0
          65.0       1.1
          67.0       7.5
          68.0      21.2
          69.0      76.5
          70.0      80.4
          71.0      11.0
          73.0       3.4
          79.0       1.0
          81.0       2.9
          82.0      12.3
          83.0      56.4
          84.0      82.6
          85.0       7.1
          95.0       1.0
          97.0       6.1
         100.0       1.1
         112.0       5.0
    

in CDCl3

90 MHz in CDCl3




  • 1H NMR 89.56 MHz
    C8 H18 O 0.05 ml : 0.5 ml CDCl3
    1-octanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.604 B 2.40 C 1.55 to 1.48 D 1.29 E 0.884

         Hz     ppm     Int.
    

        327.38   3.656     87
        323.31   3.610    156
        317.44   3.545     99
        215.19   2.403    116
        156.38   1.747     30
        156.06   1.743     30
        155.38   1.735     33
        155.06   1.732     33
        154.56   1.726     35
        153.94   1.719     37
        153.19   1.711     39
        152.88   1.708     41
        150.38   1.680     49
        149.06   1.665     58
        146.13   1.632     87
        145.63   1.627     88
        145.31   1.623     88
        145.19   1.622     88
        144.94   1.619     88
        144.56   1.615     88
        139.06   1.553    138
        138.75   1.550    137
        137.44   1.535    130
        137.00   1.530    129
        136.69   1.527    129
        136.38   1.523    128
        136.06   1.520    129
        135.75   1.516    130
        133.69   1.493    141
        132.44   1.479    146
        131.88   1.473    146
        130.69   1.460    144
        115.06   1.285   1000
        100.81   1.126     55
         99.38   1.110     46
         98.81   1.104     44
         98.38   1.099     43
         97.50   1.089     40
         97.00   1.084     39
         96.56   1.079     38
         95.69   1.069     37
         94.94   1.061     35
         94.50   1.056     37
         94.13   1.052     36
         93.69   1.047     35
         93.38   1.043     35
         92.69   1.035     36
         92.31   1.031     36
         92.00   1.028     36
         91.38   1.021     37
         90.94   1.016     38
         84.19   0.941    160
         79.00   0.883    408
         73.19   0.818    112
    

in CDCl3



CCl4 solution



liquid film



4880 A,100M,liquid