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网站主页CAS数据库列表 461-89-2更多图谱6-氮杂脲嘧啶(461-89-2)质谱(MS)

6-氮杂脲嘧啶

产品名称 6-氮杂脲嘧啶

CAS号461-89-2

分子式C3H3N3O2

分子量113.07

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  • Mass

    MS-NW-1179          
    1,2,4-triazine-3,5(2H,4H)-dione
    C3H3N3O2            (Mass of molecular ion:    113)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Direct, 75 eV
    

          12.0       1.0
          13.0       3.7
          14.0       4.9
          16.0       1.2
          18.0       1.8
          26.0       1.0
          27.0       5.7
          28.0       6.5
          29.0       8.8
          40.0       1.0
          41.0      13.5
          42.0     100.0
          43.0      24.4
          44.0      25.4
          54.0       1.9
          69.0       2.0
          70.0      26.0
         113.0      55.5
         114.0       2.6
         129.0       1.1
    

parameter in DMSO-d6


  • 1H NMR 300 MHz
    C3 H3 N3 O2 0.037 g : 0.5 ml DMSO-d6
    1,2,4-triazine-3,5(2H,4H)-dione
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) *1 12.3 D(B) *1 11.9 D(C) 7.388

         Hz     ppm     Int.
    

       3690.00  12.300    124
       3570.07  11.900     90
       2216.39   7.388   1000
    

KBr disc



nujol mull



4880 A,150M,powder