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346-55-4

4-氯-7-三氟甲基喹啉(346-55-4)红外图谱(IR3)

分子式:C10H5ClF3N

分子量: 231.6

InChI:InChI=1S/C10H5ClF3N/c11-8-3-4-15-9-5-6(10(12,13)14)1-2-7(8)9/h1-5H

InChIKey: LLRQVSZVVAKRJA-UHFFFAOYSA-N

Smiles:N1C2C(=CC=C(C(F)(F)F)C=2)C(Cl)=CC=1

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    Mass

    MS-IW-1176          
    4-chloro-7-(trifluoromethyl)quinoline
    C10H5ClF3N          (Mass of molecular ion:    231)
    

       Source Temperature: 240 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          50.0       1.6
          69.0       1.3
          74.0       3.0
          75.0       3.0
          88.5       1.8
          97.5       3.1
          98.0       1.7
          99.0       3.7
         100.0       1.6
         115.5       2.7
         119.0       1.8
         126.0       1.4
         127.0       2.1
         143.0       1.0
         145.0       1.0
         146.0       1.3
         149.0       2.5
         150.0       1.0
         162.0       2.1
         168.0       1.7
         169.0      15.1
         170.0       1.6
         176.0       9.0
         177.0       1.3
         181.0       5.1
         183.0       1.7
         194.0       1.3
         196.0      49.7
         197.0       5.5
         212.0       6.6
         213.0       1.0
         214.0       2.1
         230.0       2.3
         231.0     100.0
         232.0      12.2
         233.0      32.8
         234.0       3.7
    

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in DMSO-d6

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KBr disc

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nujol mull

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