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3-苯氧基-1,2-丙二醇

产品名称 3-苯氧基-1,2-丙二醇

CAS号538-43-2

分子式C9H12O3

分子量168.19

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  • Mass

    MS-KW-0517          
    3-phenoxy-1,2-propanediol
    C9H12O3             (Mass of molecular ion:    168)
    

       Source Temperature: 140 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          19.0       1.5
          27.0       1.6
          29.0       3.0
          31.0       3.8
          39.0       3.9
          43.0       4.2
          45.0       1.6
          50.0       1.1
          51.0       4.9
          55.0       1.0
          57.0       3.2
          61.0       3.1
          63.0       1.0
          65.0       5.1
          66.0       4.3
          74.0       1.2
          75.0       1.0
          77.0      15.3
          78.0       5.3
          79.0       3.3
          91.0       2.5
          93.0       1.8
          94.0     100.0
          95.0      13.3
         107.0       5.5
         108.0       6.5
         119.0       4.3
         137.0       2.4
         168.0      27.1
         169.0       2.9
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C9H12O3 0.041 g : 0.5 ml CDCl3
    3-phenoxy-1,2-propanediol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.239 B 6.939 C 6.865 D 4.074 E 3.955 F 3.83 G *1 3.777 J *1 3.692 K 3.49

         Hz     ppm     Int.
    

       2904.79   7.266     66
       2902.35   7.260    380
       2901.49   7.258    184
       2900.27   7.255    150
       2897.47   7.248     97
       2895.02   7.242    533
       2893.56   7.238    566
       2891.24   7.233     94
       2888.31   7.225    174
       2887.09   7.222    216
       2886.24   7.220    471
       2883.79   7.214     67
       2781.74   6.959    130
       2780.64   6.956    229
       2779.67   6.953    153
       2773.32   6.938    378
       2772.47   6.935    210
       2766.97   6.922    107
       2766.00   6.919    183
       2764.90   6.916    112
       2749.52   6.878    504
       2748.42   6.875    604
       2746.34   6.870    176
       2742.68   6.861    191
       2741.70   6.858    294
       2740.73   6.856    524
       2739.63   6.853    441
       2737.07   6.847     62
       1631.23   4.081     98
       1625.98   4.068    111
       1583.38   3.961   1000
       1577.89   3.947    712
       1533.09   3.835    160
       1529.18   3.826    150
       1517.09   3.795     75
       1505.25   3.766    128
       1482.06   3.708     99
       1476.32   3.693     90
       1470.59   3.679     55
       1464.24   3.663     34
       1395.39   3.491    128
    

in CDCl3



KBr disk



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