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网站主页CAS数据库列表 100-66-3更多图谱苯甲醚(100-66-3)红外图谱(IR2)

苯甲醚

产品名称 苯甲醚

CAS号100-66-3

分子式C7H8O

分子量108.14

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  • Mass

    MS-NW-0751          
    anisole
    C7H8O               (Mass of molecular ion:    108)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.2
          27.0       1.6
          28.0       1.4
          37.0       1.9
          38.0       4.7
          39.0      19.7
          40.0       1.0
          41.0       1.1
          43.0       1.3
          50.0       6.5
          51.0      11.4
          52.0       2.8
          57.0       1.0
          61.0       1.0
          62.0       2.2
          63.0       6.7
          64.0       3.9
          65.0      53.9
          66.0       4.0
          74.0       2.4
          75.0       1.2
          76.0       1.2
          77.0      15.2
          78.0      52.0
          79.0      11.8
          80.0       1.4
          92.0       1.5
          93.0      13.9
          94.0       2.8
         107.0       2.7
         108.0     100.0
         109.0       7.9
    

400 MHz in CDCl3

parameter N acetone-d6


  • 1H NMR 399.65 MHz
    C7 H8 O 0.05 ml : 0.5 ml CDCl3
    anisole
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.259 B 6.919 C 6.880 D 3.745

         Hz     ppm     Int.
    

       2911.87   7.287     37
       2909.42   7.280    190
       2908.57   7.278     87
       2907.35   7.275     77
       2904.54   7.268     48
       2902.10   7.262    257
       2900.63   7.258    243
       2898.32   7.253     51
       2895.39   7.245     91
       2894.17   7.242     93
       2893.31   7.240    238
       2890.87   7.234     44
       2773.93   6.941     61
       2772.83   6.939    114
       2771.85   6.936     78
       2766.48   6.923     84
       2765.50   6.920    194
       2764.65   6.918    110
       2759.28   6.905     59
       2758.18   6.902    111
       2757.08   6.899     97
       2755.98   6.896     62
       2754.64   6.893    243
       2753.54   6.890    273
       2752.56   6.888    157
       2751.34   6.885     86
       2747.80   6.876     89
       2746.83   6.874    139
       2745.73   6.871    247
       2744.75   6.868    219
       2742.19   6.862     43
       1496.70   3.746   1000
    


  • 1H NMR 300 MHz
    C7 H8 O 1.0 M in acetone-d6
    anisole
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 6.904 D(B) 7.259 D(C) 6.901 J(A,A') 2.71 J(A,B) 8.30 J(A,B') 0.40 J(A,C) 1.05 J(A',B) 0.40 J(A',B') 8.30 J(A',C) 1.05 J(B,B') 1.83 J(B,C) 7.40 J(B',C) 7.40 D(D) 3.741 SCOTT,K.N. J.MAGN.RESON. 2, 361 (1970)

         Hz     ppm     Int.
    

       2186.08   7.287     82
       2184.16   7.281     30
       2182.22   7.274     11
       2179.61   7.265     50
       2178.22   7.261    125
       2177.16   7.257     94
       2175.71   7.252     29
       2175.05   7.250     25
       2173.83   7.246     21
       2169.93   7.233    110
       2167.39   7.225     16
       2076.82   6.923     91
       2075.69   6.919    163
       2072.85   6.909     58
       2071.20   6.904     44
       2070.01   6.900    124
       2069.12   6.897     94
       2068.10   6.894     78
       2067.17   6.891    110
       2066.25   6.887    126
       2063.61   6.879     43
       2062.62   6.875     42
       2061.59   6.872     20
       1122.31   3.741   1000
    

in CDCl3



CCl4 solution



liquid film



4880 A,200 M,liquid