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网站主页CAS数据库列表 61931-81-5更多图谱乳酸叶醇酯(61931-81-5)核磁图(1HNMR)

乳酸叶醇酯

产品名称 乳酸叶醇酯

CAS号61931-81-5

分子式C9H16O3

分子量172.22

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  • Mass

    MS-NW-1484          
    cis-3-hexenyl lactate
    C9H16O3             (Mass of molecular ion:    172)
    

       Source Temperature: 250 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          15.0       4.1
          17.0       1.3
          18.0       5.9
          19.0       3.5
          26.0       1.6
          27.0      18.2
          28.0       3.4
          29.0      11.7
          31.0       2.8
          39.0      15.7
          40.0       2.9
          41.0      43.5
          42.0       7.4
          43.0      17.0
          44.0       3.0
          45.0     100.0
          46.0       2.4
          50.0       1.0
          51.0       2.0
          52.0       1.0
          53.0       7.7
          54.0      10.1
          55.0      52.8
          56.0       4.4
          57.0       3.7
          58.0       1.6
          59.0       1.4
          65.0       1.6
          66.0       1.3
          67.0      93.2
          68.0       6.2
          69.0       4.3
          70.0       3.5
          71.0       1.1
          75.0       2.7
          79.0       2.3
          80.0       1.3
          81.0       9.7
          82.0      99.3
          83.0      16.6
          84.0       1.1
          99.0       4.4
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C9 H16 O3 0.04 ml : 0.5 ml CDCl3
    cis-3-hexenyl lactate
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 5.52 B *1 5.30 C 4.26 D 4.17 E 2.95 F 2.41 G 2.05 J 1.409 K 0.97

         Hz     ppm     Int.
    

        501.25   5.597     37
        497.25   5.553     44
        491.50   5.488     46
        490.44   5.477     99
        484.56   5.411    146
        478.69   5.345     96
        477.56   5.333     49
        471.81   5.269     45
        467.88   5.225     34
        392.38   4.382     48
        385.44   4.304    142
        381.50   4.260    145
        381.00   4.255    155
        378.56   4.227    153
        374.31   4.180    402
        371.75   4.151     68
        367.50   4.104    265
        264.38   2.952     74
        225.88   2.523     53
        218.94   2.445    160
        212.56   2.374    155
        205.81   2.299     58
        191.63   2.140     91
        191.06   2.134     74
        185.13   2.068    110
        184.38   2.059    161
        177.69   1.985     95
        177.19   1.979    107
        170.19   1.901     40
        129.69   1.449   1000
        122.75   1.371    940
        120.56   1.347     43
         94.31   1.054    325
         87.13   0.973    627
         86.63   0.968    489
         79.38   0.887    243
         78.81   0.880    146
    

in CDCl3



liquid film



4880 A,200 M,liquid