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网站主页CAS数据库列表 14392-72-4更多图谱4'-羟基苯庚酮(14392-72-4)质谱(MS)

4'-羟基苯庚酮

产品名称 4'-羟基苯庚酮

CAS号14392-72-4

分子式C13H18O2

分子量206.28

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  • Mass

    MS-IW-7596          
    4'-hydroxyheptanophenone
    C13H18O2            (Mass of molecular ion:    206)
    

       Source Temperature: 150 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          18.0       3.7
          27.0       2.0
          29.0       1.9
          39.0       5.3
          41.0       3.6
          43.0       2.1
          53.0       1.0
          55.0       3.0
          63.0       1.3
          64.0       1.2
          65.0      10.3
          66.0       1.4
          77.0       1.6
          79.0       1.3
          92.0       1.5
          93.0      12.0
          94.0       5.2
         107.0       1.8
         120.0       1.1
         121.0     100.0
         122.0       8.1
         123.0       1.4
         131.0       1.2
         136.0      87.0
         137.0       7.8
         149.0       9.5
         150.0       1.0
         159.0       1.2
         188.0       1.1
         206.0       7.8
         207.0       1.2
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C13 H18 O2 0.042 g : 0.5 ml CDCl3
    4'-hydroxyheptanophenone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.20 B 7.922 C 6.974 D 2.943 E 1.725 F 1.36 G 1.294 J 0.869

         Hz     ppm     Int.
    

       3279.05   8.205    748
       3173.46   7.941     80
       3170.65   7.934    695
       3168.70   7.929    220
       3163.82   7.917    225
       3161.87   7.912    754
       3159.06   7.905     91
       2794.31   6.992     91
       2791.50   6.985    818
       2789.43   6.980    239
       2784.67   6.968    233
       2782.59   6.963    793
       2779.79   6.956     91
       1184.20   2.964    388
       1176.76   2.945    502
       1169.19   2.926    429
        704.96   1.764     71
        697.75   1.746    184
        690.06   1.727    290
        682.62   1.709    213
        675.05   1.690    106
        562.62   1.408     38
        561.16   1.405     33
        555.91   1.391    119
        554.20   1.387    114
        548.34   1.373    169
        546.75   1.369    158
        543.33   1.360    127
        541.50   1.355    130
        539.92   1.351    144
        534.30   1.337    100
        533.08   1.334     88
        530.88   1.329     78
        525.76   1.316    179
        521.97   1.307    453
        519.04   1.299    443
        515.01   1.289    499
        511.23   1.280    306
        507.69   1.271    149
        502.81   1.259     40
        354.13   0.887    331
        352.17   0.882    187
        350.83   0.878    223
        347.17   0.869   1000
        341.55   0.855    194
        340.09   0.851    288
        337.28   0.844     63
    

in CDCl3



KBr disc



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