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29663-54-5

六氟磷酸卓翁(29663-54-5)质谱(MS)

产品名称:六氟磷酸卓翁

CAS:29663-54-5

分子式:C7H7F6P

分子量: 236.09

InChI:InChI=1S/C7H7.F6P/c1-2-4-6-7-5-3-1;1-7(2,3,4,5)6/h1-7H;/q+1;-1

InChIKey: ZCBPSALVMPRNKG-UHFFFAOYSA-N

Smiles:[P-](F)(F)(F)(F)(F)F.C1C=C[CH+]C=CC=1

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    Mass

    MS-NW-7934          
    tropylium hexafluorophosphate
    C7H7F6P             (Mass of molecular ion:    236)
    

       Source Temperature: 190 °C
       Sample Temperature: 260 °C
       Direct, 75 eV
    

          18.0       3.1
          20.0      10.7
          26.0       1.8
          27.0       3.8
          31.0       1.8
          33.0       1.0
          37.0       3.5
          38.0       6.7
          39.0      24.8
          40.0       2.2
          41.0       3.3
          43.0       3.1
          44.0       9.9
          45.0       2.1
          45.5       4.4
          49.0       1.6
          50.0       7.6
          51.0      11.1
          52.0       4.4
          53.0       1.2
          53.5       1.2
          57.0       7.4
          59.0       2.0
          61.0       4.2
          62.0       8.0
          63.0      18.6
          64.0       5.4
          65.0      54.8
          66.0       3.8
          69.0       2.4
          70.0       1.1
          74.0       1.6
          75.0       1.5
          76.0       1.9
          77.0       3.1
          78.0       5.3
          81.0       2.2
          83.0      20.1
          84.0       1.9
          85.0       5.3
          86.0       2.1
          87.0       1.5
          88.0      15.9
          89.0      18.3
          90.0       9.5
          91.0      83.4
          92.0      14.5
          93.0       1.1
         104.0       3.0
         107.0      66.2
         109.0     100.0
         110.0      42.1
         111.0       2.9
         152.0       1.0
         165.0       2.4
         178.0       4.5
         179.0       6.5
         180.0       4.9
    

parameter in DMSO-d6

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    1H NMR 300 MHz
    C7 H7 F6 P 0.037 g : 0.5 ml DMSO-d6
    tropylium hexafluorophosphate
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 9.34

         Hz     ppm     Int.
    

       2802.00   9.340   1000
    

KBr disc

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nujol mull

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