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网站主页CAS数据库列表 123-04-6更多图谱氯代异辛烷(123-04-6)核磁图(13CNMR)

氯代异辛烷

产品名称 氯代异辛烷

CAS号123-04-6

分子式C8H17Cl

分子量148.67

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  • Mass

    MS-KW-0164          
    3-(chloromethyl)heptane
    C8H17Cl             (Mass of molecular ion:    148)
    

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

          27.0       5.5
          29.0       8.8
          36.0       1.8
          39.0       4.2
          41.0      19.2
          42.0       3.7
          43.0      19.1
          53.0       1.6
          55.0      20.4
          56.0       7.0
          57.0     100.0
          58.0       4.5
          69.0       4.2
          70.0       5.9
          71.0       1.5
          83.0       5.4
          98.0       6.0
          99.0      18.4
         100.0       1.4
         112.0       1.7
         119.0       2.8
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C8 H17 Cl 0.05 ml : 0.5 ml CDCl3
    3-(chloromethyl)heptane
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 3.543 B *1 3.526 C 1.590 D 1.43 E 1.30 F 0.906 G 0.894

         Hz     ppm     Int.
    

       1426.88   3.571     42
       1422.00   3.559     51
       1416.14   3.544    391
       1414.18   3.539    393
       1411.13   3.531    384
       1409.06   3.526    381
       1403.32   3.512     45
       1398.19   3.499     42
        636.23   1.592     90
        630.00   1.577     82
        588.75   1.474     65
        582.15   1.457    112
        581.18   1.455    156
        574.71   1.439    252
        573.73   1.436    189
        568.48   1.423    178
        567.26   1.420    270
        564.82   1.414     68
        561.16   1.405    179
        560.06   1.402    131
        557.13   1.395     93
        553.59   1.386    134
        550.66   1.378     72
        547.12   1.369    112
        544.19   1.362     96
        540.65   1.353     80
        538.33   1.348    153
        535.89   1.341     86
        532.35   1.333    122
        530.27   1.327    153
        528.08   1.322    133
        524.90   1.314    225
        520.75   1.304    247
        516.97   1.294    203
        514.65   1.288    151
        513.31   1.285    157
        510.13   1.277    138
        509.16   1.275    107
        507.08   1.269     82
        505.37   1.265     78
        504.03   1.262     67
        501.71   1.256     88
        369.02   0.924    308
        366.82   0.918    217
        364.87   0.913    630
        362.18   0.907    677
        359.74   0.901    178
        357.30   0.895   1000
        355.10   0.889    375
        352.05   0.881     85
        349.85   0.876    472
    

in CDCl3



Liquid film