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616-29-5

1,3-二氨基-2-羟基丙烷(616-29-5)质谱(MS)

分子式:C3H10N2O

分子量: 90.12

InChI:InChI=1S/C3H10N2O/c4-1-3(6)2-5/h3,6H,1-2,4-5H2

InChIKey: UYBWIEGTWASWSR-UHFFFAOYSA-N

Smiles:C(N)C(O)CN

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    Mass

    MS-NW-1528          
    1,3-diamino-2-propanol
    C3H10N2O            (Mass of molecular ion:     90)
    

       Source Temperature: 240 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          15.0       5.3
          17.0       1.4
          18.0      21.4
          27.0       1.4
          28.0      12.9
          29.0       2.6
          30.0     100.0
          31.0       3.5
          32.0       1.2
          41.0       2.1
          42.0      18.4
          43.0       5.6
          44.0       6.7
          45.0       2.5
          55.0       1.5
          56.0       4.8
          59.0       1.5
          60.0      31.5
          61.0       3.8
          71.0      10.3
          72.0       8.0
          73.0       2.0
    

90 MHz in D2O

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    1H NMR 89.56 MHz
    C3 H10 N2 O 0.025 g : 0.5 ml D2O
    1,3-diamino-2-propanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.571 B *1 2.677 C *1 2.580 SOLVENT PEAK REMOVED

         Hz     ppm     Int.
    

        332.81   3.717     43
        327.88   3.662     88
        325.75   3.638    119
        323.50   3.613     85
        321.06   3.585    237
        318.69   3.559    113
        315.94   3.528    123
        313.88   3.505    165
        309.19   3.453     90
        239.88   2.679    927
        237.44   2.652   1000
        235.13   2.626    830
        230.25   2.571    719
    

KBr disc

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liquid film

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nujol mull

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4880 A,200 M,powder

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