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返回ChemicalBook首页>CAS数据库列表>69045-84-7更多图谱> 2,3-二氯-5-三氟甲基吡啶(69045-84-7)质谱(MS)

69045-84-7

2,3-二氯-5-三氟甲基吡啶(69045-84-7)质谱(MS)

分子式:C6H2Cl2F3N

分子量: 215.99

InChI:InChI=1S/C6H2Cl2F3N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H

InChIKey: ABNQGNFVSFKJGI-UHFFFAOYSA-N

Smiles:C1(Cl)=NC=C(C(F)(F)F)C=C1Cl

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    Mass

    MS-IW-4768          
    2,3-dichloro-5-(trifluoromethyl)pyridine
    C6H2Cl2F3N          (Mass of molecular ion:    215)
    

       Source Temperature: 210 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          28.0       1.5
          31.0       2.0
          37.0       1.2
          49.0       2.1
          50.0       3.2
          51.0       2.4
          60.0       1.9
          62.0       1.2
          67.0       3.0
          68.0       1.0
          69.0      18.4
          74.0       1.0
          75.0       9.5
          76.0       4.5
          80.5       1.0
          84.0       3.2
          85.0       5.9
          86.0       1.9
          87.0       2.0
          91.0       1.4
          93.0       1.5
          94.0       2.2
          95.0       1.2
          98.0       1.4
          99.0       2.0
         107.5       1.3
         109.0       2.6
         110.0       4.0
         111.0       1.5
         112.0       1.3
         119.0       2.3
         126.0       1.4
         130.0       3.1
         132.0       1.0
         133.0       1.7
         144.0       2.5
         146.0       1.3
         153.0       4.9
         155.0       1.6
         160.0      14.7
         161.0       1.2
         162.0       5.0
         165.0       2.3
         167.0       1.5
         180.0      65.4
         181.0       5.2
         182.0      20.9
         183.0       1.7
         196.0       9.0
         197.0       1.0
         198.0       6.0
         215.0     100.0
         216.0       7.5
         217.0      64.6
         218.0       4.7
         219.0      10.4
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H2 Cl2 F3 N 0.05 ml : 0.5 ml CDCl3
    2,3-dichloro-5-(trifluoromethyl)pyridine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.591 B 8.034

         Hz     ppm     Int.
    

       3435.06   8.596    768
       3434.20   8.594    843
       3432.86   8.590    827
       3432.01   8.588    723
       3426.03   8.573     23
       3425.29   8.571     20
       3212.40   8.039   1000
       3211.79   8.037    991
       3211.06   8.035    717
       3210.21   8.033    971
       3209.59   8.032    904
       3203.37   8.016     22
       3202.88   8.015     21
    

in CDCl3

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liquid film

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