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102-71-6

三乙醇胺(102-71-6)Raman光谱

产品名称:三乙醇胺

CAS:102-71-6

分子式:C6H15NO3

分子量: 149.19

InChI:InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2

InChIKey: GSEJCLTVZPLZKY-UHFFFAOYSA-N

Smiles:N(CCO)(CCO)CCO

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    Mass

    MS-NW-5536          
    2,2',2''-nitrilotriethanol
    C6H15NO3            (Mass of molecular ion:    149)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          15.0       4.0
          17.0       1.0
          18.0       4.0
          19.0       2.2
          26.0       1.2
          27.0       6.4
          29.0       3.4
          30.0      15.0
          31.0       3.5
          41.0       3.3
          42.0      13.4
          43.0       4.9
          44.0       8.2
          45.0      23.4
          54.0       1.3
          55.0       1.4
          56.0      36.5
          57.0       3.2
          58.0       2.5
          70.0       2.9
          72.0       1.5
          73.0       1.1
          74.0      37.6
          75.0       2.2
          86.0       2.4
          88.0       2.9
         100.0       2.8
         104.0       1.5
         116.0       1.4
         118.0     100.0
         119.0       6.1
         126.0       1.0
         129.0       1.6
         130.0       2.0
         174.0       4.6
    

90 MHz in CDCl3

in CDCl3

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    1H NMR 89.56 MHz
    C6 H15 N O3 0.04 ml : 0.5 ml CDCl3
    2,2',2''-nitrilotriethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.6 B 3.617 C 2.603

         Hz     ppm     Int.
    

        410.56   4.585    122
        329.38   3.678    759
        327.38   3.656    337
        324.69   3.626    984
        323.44   3.612    744
        321.38   3.589    400
        319.63   3.569   1000
        312.63   3.491     46
        310.81   3.471     35
        249.13   2.782     38
        248.75   2.778     38
        248.19   2.772     36
        247.31   2.762     35
        245.88   2.746     40
        243.88   2.724     57
        242.44   2.708     60
        237.75   2.655    936
        235.94   2.635    387
        233.94   2.613    660
        232.69   2.599    951
        230.06   2.569    348
        228.00   2.546    752
    

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in CDCl3

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liquid film

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4880 A,200 M,liquid

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