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网站主页CAS数据库列表 10574-69-3更多图谱3-苄基若丹宁(10574-69-3)核磁图(1HNMR)

3-苄基若丹宁

产品名称 3-苄基若丹宁

CAS号10574-69-3

分子式C10H9NOS2

分子量223.31

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  • Mass

    MS-IW-6147          
    3-benzyl-2-thioxo-4-thiazolidinone
    C10H9NOS2           (Mass of molecular ion:    223)
    

       Source Temperature: 130 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          39.0       5.1
          41.0       1.4
          45.0       2.9
          46.0       2.1
          50.0       1.4
          51.0       3.8
          63.0       3.8
          64.0       1.3
          65.0      14.4
          72.0       1.0
          77.0       2.9
          83.0       1.4
          89.0       5.1
          90.0       2.7
          91.0      71.7
          92.0       5.7
          97.5       2.5
         104.0       8.1
         105.0       2.1
         116.0       3.1
         117.0       1.9
         118.0       1.5
         121.0       4.0
         122.0       1.9
         123.0       1.8
         135.0       1.3
         136.0       1.5
         146.0       8.9
         147.0       8.8
         148.0      68.2
         149.0      13.1
         150.0       4.4
         181.0       1.2
         223.0     100.0
         224.0      13.0
         225.0       9.8
         226.0       1.1
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C10 H9 N O S2 0.040 g : 0.5 ml CDCl3
    3-benzyl-2-thioxo-4-thiazolidinone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.419 B 7.30 to 7.28 C 5.164 D 3.934

         Hz     ppm     Int.
    

       2970.95   7.434    104
       2968.75   7.429     92
       2966.80   7.424     53
       2966.19   7.422     45
       2965.33   7.420     61
       2964.60   7.418     76
       2963.50   7.416    107
       2962.89   7.414    151
       2961.30   7.410    144
       2926.76   7.324     38
       2923.22   7.315     51
       2921.14   7.310     41
       2918.46   7.303    155
       2917.72   7.301    159
       2916.14   7.297     88
       2913.57   7.291    111
       2912.60   7.288    127
       2911.25   7.285    223
       2910.52   7.283    226
       2909.42   7.280    123
       2907.59   7.276     32
       2905.88   7.272     47
       2904.54   7.268     40
       2063.72   5.164    495
       1572.39   3.935   1000
    

in CDCl3



KBr disc



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