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网站主页CAS数据库列表 63989-40-2更多图谱H-(2-羟乙基)2-氰基-4-硝基苯胺(63989-40-2)核磁图(13CNMR)

H-(2-羟乙基)2-氰基-4-硝基苯胺

产品名称 H-(2-羟乙基)2-氰基-4-硝基苯胺

CAS号63989-40-2

分子式C9H9N3O3

分子量207.19

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  • Mass

    MS-IW-2653          
    2-(2-hydroxyethylamino)-5-nitrobenzonitrile
    C9H9N3O3            (Mass of molecular ion:    207)
    

       Source Temperature: 140 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          17.0       1.3
          18.0       6.5
          27.0       1.7
          28.0       3.5
          30.0       1.0
          31.0       1.7
          38.0       1.1
          39.0       1.2
          43.0       1.0
          45.0       1.1
          50.0       3.2
          51.0       1.9
          52.0       2.1
          62.0       1.4
          63.0       2.3
          64.0       1.3
          74.0       1.3
          75.0       4.3
          76.0       7.8
          77.0       1.9
          78.0       1.0
          88.0       1.2
          89.0       1.3
          90.0       2.2
         101.0       2.3
         102.0       3.0
         103.0      10.9
         104.0       2.2
         117.0       1.0
         118.0       2.9
         129.0       7.0
         130.0      54.5
         131.0       6.5
         146.0       1.4
         160.0       4.0
         176.0     100.0
         177.0      13.6
         178.0       1.2
         207.0      23.8
         208.0       2.7
    

400 MHz in DMSO-d6


  • 1H NMR 399.65 MHz
    C9 H9 N3 O3 0.031 g : 0.5 ml DMSO-d6
    2-(2-hydroxyethylamino)-5-nitrobenzonitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.410 B 8.190 C *1 7.37 D 6.975 E *1 4.92 F 3.601 G 3.413

         Hz     ppm     Int.
    

       3362.55   8.414    968
       3359.86   8.408   1000
       3279.79   8.207    305
       3279.30   8.206    328
       3277.10   8.200    296
       3276.49   8.199    310
       3270.26   8.183    322
       3269.65   8.182    345
       3267.46   8.176    316
       3266.97   8.175    319
       2951.54   7.386    136
       2945.92   7.372    252
       2940.31   7.358    136
       2792.60   6.988    647
       2787.48   6.975     36
       2782.96   6.964    627
       1973.14   4.938    362
       1967.65   4.924    827
       1962.16   4.910    379
       1448.36   3.625    236
       1442.50   3.610    735
       1436.89   3.596    818
       1431.15   3.582    317
       1372.56   3.435    280
       1366.82   3.421    707
       1360.96   3.406    635
       1355.10   3.391    209
    

in DMSO-d6



KBr disc



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