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1478-61-1

六氟双酚 A(1478-61-1)Raman光谱

产品名称:六氟双酚 A

CAS:1478-61-1

分子式:C15H10F6O2

分子量: 336.23

InChI:InChI=1S/C15H10F6O2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8,22-23H

InChIKey: ZFVMWEVVKGLCIJ-UHFFFAOYSA-N

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

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    Mass

    MS-NW-7978          
    4,4'-(hexafluoroisopropylidene)diphenol
    C15H10F6O2          (Mass of molecular ion:    336)
    

       Source Temperature: 170 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          18.0       3.9
          27.0       1.3
          39.0       4.7
          50.0       1.2
          51.0       2.1
          53.0       1.8
          55.0       2.8
          57.0       1.1
          62.0       1.2
          63.0       3.7
          64.0       1.1
          65.0       2.8
          69.0       1.5
          70.0       1.0
          71.0       1.0
          72.0       1.6
          75.0       2.0
          76.0       4.1
          77.0       1.3
          84.0       3.4
          84.5       1.0
          85.0       1.6
          89.0       1.0
          90.0       4.2
          94.0       1.0
          98.5       3.2
          99.0      16.6
          99.5       3.0
         100.0       1.0
         115.0       3.6
         123.0       1.0
         123.5       1.1
         125.0       1.1
         133.0       1.4
         133.5       3.0
         139.0       2.6
         141.0       3.1
         143.0       2.9
         145.0       1.0
         151.0       2.0
         152.0       2.1
         158.0       1.0
         168.0       4.5
         169.0       8.0
         170.0       3.5
         171.0       2.0
         181.0       4.6
         188.0       1.2
         189.0       1.3
         197.0      15.1
         198.0       7.1
         199.0      14.9
         200.0       2.7
         201.0       4.4
         217.0       2.7
         218.0       1.3
         219.0       4.4
         227.0       7.6
         228.0       1.7
         229.0       2.2
         230.0       1.2
         237.0       1.2
         238.0       2.2
         246.0       2.0
         247.0       3.5
         248.0       1.8
         249.0       1.8
         265.0       1.6
         266.0       2.4
         267.0     100.0
         268.0      15.5
         269.0       1.8
         317.0       5.2
         335.0       2.2
         336.0      52.3
         337.0       8.8
    

90 MHz in DMSO-d6

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    1H NMR 89.56 MHz
    C15 H10 F6 O2 saturated in DMSO-d6
    4,4'-(hexafluoroisopropylidene)diphenol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.88 B 7.13 C 6.845

         Hz     ppm     Int.
    

        884.99   9.882    966
        635.67   7.098    523
        619.26   6.915    151
        618.68   6.908    147
        616.48   6.884   1000
        614.28   6.859    290
        612.01   6.834    121
        611.72   6.831    109
        611.21   6.825    115
        609.67   6.808    217
        607.40   6.783    546
        605.42   6.760    111
        604.76   6.753    101
    

KBr disc

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nujol mull

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