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网站主页CAS数据库列表 1594-56-5更多图谱二硝散(1594-56-5)核磁图(1HNMR)

二硝散

产品名称 二硝散

CAS号1594-56-5

分子式C7H3N3O4S

分子量225.18

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  • Mass

    MS-NW-2415          
    2,4-dinitrophenyl thiocyanate
    C7H3N3O4S           (Mass of molecular ion:    225)
    

       Source Temperature: 210 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          17.0       1.3
          18.0       6.7
          26.0       1.1
          27.0       1.7
          28.0       5.4
          29.0       1.5
          30.0     100.0
          32.0       1.3
          37.0       4.5
          38.0       6.8
          39.0       5.1
          43.0       2.2
          44.0       2.4
          45.0      16.7
          46.0       3.6
          48.0       1.3
          49.0       1.5
          50.0       5.4
          51.0       7.2
          52.0       2.9
          53.0       3.3
          57.0       3.7
          58.0       6.3
          60.0       1.0
          61.0       6.6
          62.0      16.7
          63.0      38.2
          64.0       6.8
          65.0       1.5
          68.0       1.1
          69.0      45.7
          70.0       9.2
          71.0       2.8
          73.0       3.5
          74.0      24.9
          75.0      25.7
          76.0       6.7
          77.0       5.5
          78.0       2.1
          79.0      22.8
          80.0       3.0
          81.0       5.3
          82.0      18.0
          83.0       7.0
          84.0       1.5
          85.0       1.0
          86.0       1.1
          87.0       1.4
          88.0      24.4
          89.0       5.4
          91.0      14.2
          92.0       1.5
          93.0       5.9
          94.0      13.4
          95.0      10.4
          96.0       2.6
          97.0       1.0
          98.0       1.0
         101.0       1.3
         103.0      10.5
         104.0       7.2
         105.0       3.5
         106.0       9.3
         107.0      15.4
         108.0       1.9
         109.0       4.0
         114.0       3.0
         115.0      29.7
         116.0       3.2
         120.0       3.1
         121.0      10.2
         122.0       2.5
         123.0       2.7
         131.0      23.5
         132.0       5.1
         133.0      16.6
         134.0       2.0
         135.0       1.0
         136.0       1.4
         137.0       5.7
         149.0       5.1
         151.0       4.2
         152.0       3.8
         161.0       6.0
         179.0       5.2
         183.0       6.1
         195.0       1.7
         209.0       1.7
         225.0      46.3
         226.0       4.5
         227.0       2.5
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C7 H3 N3 O4 S 0.045 g : 0.5 ml CDCl3
    2,4-dinitrophenyl thiocyanate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.220 B 8.620 C 8.311

         Hz     ppm     Int.
    

        827.19   9.237    584
        826.88   9.233    568
        824.81   9.210    672
        824.44   9.206    634
        778.88   8.697    471
        776.44   8.670    407
        769.94   8.597    792
        767.50   8.570    745
        747.75   8.350   1000
        747.38   8.346    921
        738.88   8.251    565
        738.44   8.246    524
    

CCl4 solution



KBr disc



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