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1190-22-3

1,3-二氯正丁烷(1190-22-3)Raman光譜

產(chǎn)品名稱:1,3-二氯正丁烷

CAS:1190-22-3

分子式:C4H8Cl2

分子量: 127.01

InChI:InChI=1S/C4H8Cl2/c1-4(6)2-3-5/h4H,2-3H2,1H3

InChIKey: QBGVARBIQGHVKR-UHFFFAOYSA-N

Smiles:C(Cl)CC(Cl)C

  • 圖譜
    Mass 

    MS-NW-4374          
1,3-dichlorobutane
C4H8Cl2             (Mass of molecular ion:    126)


       Source Temperature: 220 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV


          26.0       3.1
      27.0      23.5
      28.0       2.9
      29.0      10.8
      36.0       1.2
      38.0       1.1
      39.0       9.3
      39.5       1.2
      41.0       9.5
      41.5       1.0
      42.0       2.0
      49.0       5.4
      50.0       1.3
      51.0       1.8
      53.0       4.5
      54.0      10.9
      55.0     100.0
      56.0       4.9
      61.0       1.0
      62.0       7.4
      63.0      21.0
      64.0       2.7
      65.0       6.1
      75.0       8.9
      77.0       4.0
      90.0      29.6
      91.0       5.5
      92.0       9.7
      93.0       1.8

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C4 H8 Cl2 0.02 ml : 0.5 ml CDCl3
    1,3-dichlorobutane
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             4.25
      B             3.696
      C             2.123
      D             1.561
  

         Hz     ppm     Int.


        384.81   4.297     93
    378.06   4.222     96
    338.81   3.784    100
    337.13   3.765     96
    331.38   3.701    324
    330.75   3.694    138
    325.38   3.634    247
    325.06   3.630    234
    199.38   2.227    119
    193.31   2.159    200
    192.56   2.151    167
    187.25   2.091    143
    186.25   2.080    201
    180.31   2.014     87
    179.94   2.010     81
    143.13   1.599   1000
    136.50   1.525    940

in CDCl3

  • 圖譜

liquid film

  • 圖譜

4880 A,200 M,liquid

  • 圖譜

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