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133745-75-2

N-氟代双苯磺酰胺(133745-75-2)质谱(MS)

分子式:C12H10FNO4S2

分子量: 315.34

InChI:InChI=1S/C12H10FNO4S2/c13-14(19(15,16)11-7-3-1-4-8-11)20(17,18)12-9-5-2-6-10-12/h1-10H

InChIKey: RLKHFSNWQCZBDC-UHFFFAOYSA-N

Smiles:C1(S(N(F)S(C2=CC=CC=C2)(=O)=O)(=O)=O)=CC=CC=C1

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    Mass

    MS-IW-7559          
    N-fluorobenzenesulfonimide
    C12H10FNO4S2        (Mass of molecular ion:    315)
    

       Source Temperature: 180 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          39.0       1.8
          50.0       3.6
          51.0      17.2
          52.0       1.1
          63.0       1.0
          64.0       1.7
          65.0       2.6
          75.0       1.0
          76.0       1.4
          77.0      89.0
          78.0       6.5
          91.0       1.6
          97.0       2.2
         125.0       7.6
         140.0       1.9
         141.0     100.0
         142.0       7.8
         143.0       5.2
         233.0       1.0
         315.0       5.5
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C12 H10 F N O4 S2 0.039 g : 0.5 ml CDCl3
    N-fluorobenzenesulfonimide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.012 B 7.769 C 7.604

         Hz     ppm     Int.
    

       3206.54   8.024    770
       3205.57   8.021    836
       3198.12   8.003    980
       3196.90   8.000    806
       3114.50   7.794    166
       3113.28   7.791    268
       3112.06   7.787    178
       3107.30   7.776    245
       3105.71   7.772    581
       3104.13   7.768    243
       3099.37   7.756    256
       3098.14   7.753    389
       3096.92   7.750    222
       3047.85   7.627    227
       3046.26   7.623    742
       3044.56   7.619    352
       3038.70   7.604    922
       3037.96   7.602   1000
       3032.23   7.588    279
       3030.52   7.583    527
       3028.93   7.579    168
    

in CDCl3

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KBr disc

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nujol mull

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