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105-59-9

N-甲基二乙醇胺(105-59-9)核磁图(13CNMR)

产品名称:N-甲基二乙醇胺

CAS:105-59-9

分子式:C5H13NO2

分子量: 119.16

InChI:InChI=1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3

InChIKey: CRVGTESFCCXCTH-UHFFFAOYSA-N

Smiles:N(CCO)(CCO)C

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    Mass

    MS-NW-0745          
    2,2'-(methylimino)diethanol
    C5H13NO2            (Mass of molecular ion:    119)
    

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

          15.0       4.7
          18.0       3.5
          19.0       1.4
          27.0       4.8
          28.0       5.6
          29.0       2.8
          30.0       3.0
          31.0       2.4
          41.0       2.3
          42.0      15.0
          43.0       5.1
          44.0      73.7
          45.0      23.6
          56.0       4.6
          57.0       3.0
          58.0       5.5
          70.0       2.2
          71.0       1.0
          72.0       1.0
          74.0       2.9
          86.0       1.8
          88.0     100.0
          89.0       5.1
         119.0       2.5
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C5 H13 N O2 0.04 ml : 0.5 ml CDCl3
    2,2'-(methylimino)diethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.10 B 3.637 C 2.571 D 2.299

         Hz     ppm     Int.
    

        367.44   4.103    384
        331.50   3.702    301
        328.19   3.665     72
        326.38   3.645    416
        325.38   3.634    224
        323.81   3.616     84
        320.81   3.583    379
        235.50   2.630    319
        232.50   2.597     72
        229.88   2.567    366
        228.25   2.549     90
        224.88   2.511    259
        208.50   2.329     21
        206.00   2.301   1000
    

in CDCl3

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CCl4 solution

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liquid film

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4880 A,200 M,liquid

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