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3,5-二硝基苯甲醇

产品名称 3,5-二硝基苯甲醇

CAS号71022-43-0

分子式C7H6N2O5

分子量198.13

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  • Mass

    MS-NW-6947          
    3,5-dinitrobenzyl alcohol
    C7H6N2O5            (Mass of molecular ion:    198)
    

       Source Temperature: 220 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          17.0       1.7
          18.0       6.7
          26.0       1.3
          27.0       7.4
          28.0       6.9
          29.0      11.2
          30.0      31.3
          31.0      17.6
          37.0       3.2
          38.0       6.6
          39.0      21.3
          40.0       4.1
          42.0       1.0
          43.0       1.1
          46.0       3.0
          49.0       1.1
          50.0      22.8
          51.0      41.8
          52.0      18.1
          53.0       4.6
          55.0       6.0
          61.0       3.2
          62.0      13.9
          63.0      19.2
          64.0       5.7
          65.0      12.7
          66.0       6.8
          67.0       1.3
          68.0       1.0
          73.0       2.5
          74.0      18.7
          75.0      52.6
          76.0      19.3
          77.0      41.3
          78.0      16.9
          79.0       2.7
          81.0       1.2
          86.0       2.4
          87.0      10.2
          88.0      27.7
          89.0       8.8
          90.0       1.5
          91.0       1.2
          92.0       9.5
          93.0       6.8
          94.0       2.5
         103.0       3.1
         104.0       3.5
         105.0      58.7
         106.0      22.8
         107.0       3.1
         120.0       2.1
         121.0       3.6
         122.0      39.6
         123.0       7.6
         124.0       1.5
         134.0      57.7
         135.0       6.9
         136.0       1.1
         149.0       1.4
         150.0       2.5
         151.0      25.3
         152.0     100.0
         153.0      50.4
         154.0       4.2
         166.0       1.4
         168.0       1.9
         169.0      10.9
         170.0       2.1
         181.0      16.2
         182.0       3.5
         195.0       2.9
         196.0       2.4
         197.0       6.5
         198.0      22.4
         199.0       2.2
    

400 MHz in DMSO-d6


  • 1H NMR 399.65 MHz
    C7 H6 N2 O5 0.041 g : 0.5 ml DMSO-d6
    3,5-dinitrobenzyl alcohol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.705 B 8.573 C 5.87 D 4.754

         Hz     ppm     Int.
    

       3481.14   8.711    256
       3480.53   8.709    204
       3479.00   8.706    476
       3477.48   8.702    215
       3476.87   8.700    278
       3434.60   8.595     22
       3427.28   8.576   1000
       3426.36   8.574    698
       3425.14   8.571    900
       2346.19   5.871     92
       1900.02   4.755    697
    

KBr disc



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