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1193-72-2

2,4-二氯溴苯(1193-72-2)核磁图(1HNMR)

产品名称:2,4-二氯溴苯

CAS:1193-72-2

分子式:C6H3BrCl2

分子量: 225.9

InChI:InChI=1S/C6H3BrCl2/c7-5-2-1-4(8)3-6(5)9/h1-3H

InChIKey: ISHYFWKKWKXXPL-UHFFFAOYSA-N

Smiles:C1(Br)=CC=C(Cl)C=C1Cl

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    Mass

    MS-NW-7683          
    1-bromo-2,4-dichlorobenzene
    C6H3BrCl2           (Mass of molecular ion:    224)
    

       Source Temperature: 270 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          36.0       1.6
          37.0       5.3
          38.0       2.5
          49.0       3.6
          50.0       8.2
          54.0       1.2
          54.5       2.5
          55.0       3.1
          60.0       1.0
          61.0       1.7
          62.0       1.2
          72.0       4.4
          72.5       1.3
          73.0       6.9
          74.0      22.6
          75.0      16.4
          76.0       1.0
          84.0       5.6
          85.0       2.7
          86.0       2.0
          94.0       1.9
          95.0       2.5
         108.0       1.8
         109.0      23.1
         110.0       9.0
         111.0       8.0
         112.0       5.3
         113.0       6.7
         114.0       3.0
         144.0       1.1
         145.0      45.5
         146.0       3.9
         147.0      30.0
         148.0       2.2
         149.0       4.9
         161.0       2.4
         163.0       1.4
         189.0       2.1
         191.0       2.5
         224.0      62.6
         225.0       4.3
         226.0     100.0
         227.0       6.8
         228.0      45.4
         229.0       3.3
         230.0       6.6
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C6 H3 Br Cl2 0.05 ml : 0.5 ml CDCl3
    1-bromo-2,4-dichlorobenzene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.470 B 7.405 C 7.064

         Hz     ppm     Int.
    

        674.56   7.532    585
        674.31   7.530    585
        670.44   7.486     44
        665.75   7.434   1000
        664.38   7.419    796
        662.19   7.394    892
        658.38   7.352     56
        657.06   7.337     41
        637.31   7.117    681
        634.88   7.089    579
        631.69   7.054     48
        631.25   7.049     48
        628.75   7.021    456
        626.31   6.994    391
        622.75   6.954     30
    

in CDCl3

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liquid film

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4880 A,200 M,powder

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