2622-26-6

氰噻嗪(2622-26-6)核磁图(¹HNMR)

产品名称:氰噻嗪

CAS:2622-26-6

分子式:C21H23N3OS

分子量: 365.49

Mass

MS-IW-3440          
10-(3-(4-hydroxypiperidino)propyl)-2-phenothiazinecarbonitrile
C21H23N3OS          (Mass of molecular ion:    365)

   Source Temperature: 180 °C
   Sample Temperature: 190 °C
   Direct, 75 eV

      18.0       1.0
      28.0       1.6
      29.0       1.7
      30.0       1.5
      39.0       1.3
      41.0       3.8
      42.0       7.4
      43.0       3.8
      44.0      16.6
      45.0       1.2
      53.0       1.4
      55.0       2.3
      56.0       3.2
      57.0       2.4
      58.0       1.3
      68.0       1.2
      69.0       2.1
      70.0       3.8
      71.0       1.9
      77.0       1.1
      82.0       1.7
      83.0       1.1
      84.0       1.7
      96.0       2.8
      97.0       1.7
      98.0       2.7
     100.0       4.5
     101.0       1.1
     112.0       3.7
     113.0       2.3
     114.0     100.0
     115.0       9.1
     124.0       1.2
     126.0       2.9
     127.0       1.4
     128.0       8.3
     140.0       2.4
     141.0       4.3
     142.0      25.2
     143.0       2.2
     152.0       1.2
     164.0       1.4
     177.0       1.1
     179.0       2.6
     191.0       1.8
     192.0       3.5
     196.0       1.5
     204.0       1.6
     205.0       8.2
     206.0       1.5
     222.0       1.4
     223.0      11.8
     224.0      10.8
     225.0       2.2
     231.0       1.4
     235.0       1.5
     236.0       2.1
     237.0       7.4
     238.0       4.4
     239.0       1.0
     248.0       1.8
     249.0       2.9
     250.0       2.3
     251.0       1.6
     263.0      14.1
     264.0      16.6
     265.0       3.9
     266.0       1.3
     365.0      38.7
     366.0       9.9
     367.0       2.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₂₁ H₂₃ N₃ O S	0.032 g : 0.5 ml CDCl₃
10-(3-(4-hydroxypiperidino)propyl)-2-phenothiazinecarbonitrile

    Assign.     Shift(ppm)

      A             7.171
      B             7.14
      C             7.12
      D             7.081
      E             7.053
      F             6.947
      G             6.908
      J             3.891
      K             3.653
      L             2.712
      M             2.431
      N             2.102
      P             1.904
      Q             1.86
      R             1.83
      S             1.532
     
     ASSIGNED BY H-H AND C-H COSY.

     Hz     ppm     Int.

   2875.61   7.196    142
   2874.02   7.192    164
   2868.16   7.177    190
   2867.43   7.175    214
   2866.70   7.174    233
   2865.84   7.171    219
   2860.11   7.157    265
   2858.52   7.153    240
   2852.29   7.137    687
   2851.07   7.134    897
   2850.46   7.133   1000
   2849.85   7.131    957
   2842.53   7.113    105
   2842.04   7.112     81
   2834.96   7.094    259
   2833.50   7.090    264
   2827.27   7.075    366
   2825.93   7.072    329
   2818.97   7.054    453
   2818.36   7.053    473
   2784.06   6.967    199
   2782.96   6.964    247
   2776.61   6.948    284
   2775.51   6.945    328
   2769.04   6.929    153
   2767.94   6.926    171
   2765.14   6.919    288
   2764.28   6.917    269
   2756.96   6.899    248
   2756.10   6.897    228
   1562.13   3.909    254
   1555.18   3.892    389
   1548.22   3.874    274
   1468.99   3.676     46
   1468.75   3.676     46
   1464.11   3.664     67
   1459.96   3.654     87
   1455.81   3.643     69
   1455.57   3.643     69
   1451.17   3.632     50
   1090.21   2.728    129
   1087.28   2.721    103
   1084.23   2.713    124
   1083.74   2.712    122
   1078.86   2.700    146
   1074.95   2.690     95
    978.88   2.450    282
    971.92   2.432    567
    964.97   2.415    334
    853.15   2.135     82
    850.95   2.130     92
    850.71   2.129     92
    841.19   2.105    166
    840.82   2.104    165
    831.79   2.082     92
    831.54   2.081     92
    830.32   2.078     90
    829.59   2.076     90
    776.49   1.943     78
    769.53   1.926    230
    762.57   1.909    312
    755.74   1.892    230
    751.59   1.881    102
    748.66   1.874    193
    745.85   1.867    147
    744.26   1.863    157
    742.07   1.857    126
    740.72   1.854    145
    738.89   1.849    156
    735.23   1.840    200
    733.52   1.836    192
    731.45   1.831    202
    720.21   1.803     37
    719.48   1.801     34
    629.64   1.576     75
    625.85   1.566     79
    619.87   1.552    122
    616.58   1.543    184
    613.16   1.535     92
    610.72   1.529     91
    607.18   1.520    168
    603.76   1.511    110
    597.78   1.496     63
    594.12   1.487     58

in CDCl3