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78-96-6

異丙醇胺(78-96-6)質(zhì)譜(MS)

產(chǎn)品名稱:異丙醇胺

CAS:78-96-6

分子式:C3H9NO

分子量: 75.11

InChI:InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3

InChIKey: HXKKHQJGJAFBHI-UHFFFAOYSA-N

Smiles:C(N)C(O)C

  • 圖譜
    Mass 

    MS-NW-8465          
1-amino-2-propanol
C3H9NO              (Mass of molecular ion:     75)


       Source Temperature: 260 °C
   Sample Temperature: 140 °C
   Reservoir, 75 eV


          15.0       2.5
      18.0       3.2
      19.0       1.5
      27.0       4.0
      28.0      11.3
      29.0       4.5
      30.0     100.0
      31.0      16.6
      32.0       6.0
      39.0       1.0
      41.0       3.5
      42.0       7.3
      43.0       4.2
      44.0       4.7
      45.0      10.3
      56.0       3.1
      57.0       1.0
      58.0       1.0
      60.0       5.0

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C3 H9 N O 0.04 ml : 0.5 ml CDCl3
    1-amino-2-propanol
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             5.26
      B             3.70
      C     *1      2.756
      D     *1      2.520
      E             2.26
      F             1.147
     
     J(C,D) = -12.6 HZ.
     J(B,D) = 8.0 HZ.
     J(B,C) = 3.6 HZ.
  

         Hz     ppm     Int.


        471.25   5.262     42
    340.81   3.806     46
    337.19   3.765     48
    334.56   3.736     49
    332.81   3.717     57
    330.88   3.695     50
    329.19   3.676     57
    326.56   3.647     57
    322.94   3.606     58
    257.75   2.878     68
    254.13   2.838     74
    245.06   2.737    198
    241.44   2.696    174
    233.13   2.604    205
    225.19   2.515    173
    220.50   2.463     76
    212.50   2.373     78
    105.75   1.181   1000
     99.50   1.111    938

in CDCl3

  • 圖譜

CCl4 solution

  • 圖譜

liquid film

  • 圖譜

4880 A,100M,liquid

  • 圖譜

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