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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>32247-96-4更多圖譜> 3,5-雙三氟甲基芐基溴(32247-96-4)核磁圖(1HNMR)

32247-96-4

3,5-雙三氟甲基芐基溴(32247-96-4)核磁圖(1HNMR)

產(chǎn)品名稱:3,5-雙三氟甲基芐基溴

CAS:32247-96-4

分子式:C9H5BrF6

分子量: 307.03

InChI:InChI=1S/C9H5BrF6/c10-4-5-1-6(8(11,12)13)3-7(2-5)9(14,15)16/h1-3H,4H2

InChIKey: ATLQGZVLWOURFU-UHFFFAOYSA-N

Smiles:C1(CBr)=CC(C(F)(F)F)=CC(C(F)(F)F)=C1

  • 圖譜
    Mass 

    MS-NW-9778          
1-bromomethyl-3,5-bis(trifluoromethyl)benzene
C9H5BrF6            (Mass of molecular ion:    306)


       Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          63.0       1.2
      69.0       1.1
     104.0       1.9
     107.0       1.1
     127.0       1.3
     137.0       1.2
     138.0       2.8
     139.0       1.1
     157.0       1.5
     158.0       4.6
     176.0       1.0
     177.0      10.0
     187.0       4.7
     207.0       3.6
     208.0       3.5
     226.0       1.2
     227.0     100.0
     228.0       9.9
     287.0       3.6
     289.0       3.5
     306.0       1.0
     308.0       1.0

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C9 H5 Br F6 0.05 ml : 0.5 ml CDCl3
    1-bromomethyl-3,5-bis(trifluoromethyl)benzene
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.857
      B             7.826
      C             4.539
  

         Hz     ppm     Int.


       3140.14   7.858    512
   3127.69   7.827    232
   1814.09   4.540   1000

in CDCl3

  • 圖譜

liquid film

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