55770-03-1

Α-(氰基亚氨基)-3,4-二氯苯乙胺(55770-03-1)核磁图(¹³CNMR)

产品名称:Α-(氰基亚氨基)-3,4-二氯苯乙胺

CAS:55770-03-1

分子式:C9H7Cl2N3

分子量: 228.08

Mass

MS-NW-9999          
alpha-cyanoimino-3,4-dichlorophenethylamine
C9H7Cl2N3           (Mass of molecular ion:    227)

   Source Temperature: 200 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      18.0       4.2
      27.0       1.3
      28.0       5.3
      36.0       2.4
      37.0       1.3
      38.0       2.0
      39.0       4.6
      41.0       3.1
      42.0      23.6
      43.0      20.8
      44.0       1.3
      49.0       1.3
      50.0       3.6
      51.0       2.3
      56.5       1.2
      57.5       1.8
      61.0       3.2
      61.5       1.4
      62.0       5.8
      63.0      10.1
      64.0       1.8
      68.0      34.8
      69.0       1.2
      72.0       1.0
      73.0       7.6
      74.0       4.3
      74.5       1.9
      75.0       6.5
      75.5       2.2
      76.0       1.5
      82.0       1.0
      84.0       1.7
      85.0       2.3
      86.0       2.6
      87.0       4.5
      88.0       3.4
      89.0      15.0
      90.0       1.8
      92.5       1.0
      95.5       1.4
      96.0       1.4
      97.0       3.6
      99.0       4.9
     100.0       1.3
     101.0       1.7
     102.0       1.1
     107.0       1.0
     109.0       3.0
     111.0       1.8
     114.0       5.7
     115.0       2.3
     116.0       1.2
     123.0      23.5
     124.0       8.8
     125.0      19.5
     126.0       3.8
     127.0       4.2
     129.0       1.0
     133.0       3.9
     135.0       2.6
     148.0       1.4
     149.0       1.3
     150.0      78.9
     151.0      11.0
     152.0      26.3
     153.0       3.6
     156.0       1.2
     157.0       2.8
     158.0       1.2
     159.0      73.2
     160.0      11.1
     161.0      50.1
     162.0       7.0
     163.0      10.1
     164.0       1.5
     165.0       3.6
     167.0       1.0
     184.0       3.3
     185.0      51.8
     186.0      27.0
     187.0      63.7
     188.0      18.9
     189.0      25.1
     190.0       4.3
     191.0       4.3
     192.0       3.2
     194.0       1.0
     199.0       1.2
     200.0       8.8
     201.0       2.4
     202.0       5.8
     203.0       1.2
     204.0       1.0
     210.0       3.4
     212.0       2.2
     226.0      10.0
     227.0     100.0
     228.0      19.4
     229.0      64.3
     230.0       9.3
     231.0      10.6
     232.0       1.3

400 MHz in DMSO-d6 (at 50.C)

¹H NMR	399.65 MHz
C₉ H₇ Cl₂ N₃	0.041 g : 0.5 ml DMSO-d₆ at 50C
alpha-cyanoimino-3,4-dichlorophenethylamine

    Assign.     Shift(ppm)

      A     *1      8.5
      B     *1      8.4
      C             7.60
      D             7.60
      E             7.33
      F             3.71
     
     J(C,E)=8.2HZ

     Hz     ppm     Int.

   3338.01   8.353    124
   3056.95   7.650     28
   3056.49   7.648     30
   3055.27   7.645     34
   3052.98   7.640     40
   3052.52   7.638     41
   3052.06   7.637     43
   3042.76   7.614    655
   3034.52   7.593   1000
   3022.61   7.564     34
   3020.78   7.559     27
   2942.20   7.362     33
   2932.74   7.339    295
   2932.28   7.338    295
   2924.80   7.319    259
   2924.35   7.318    259
   1480.71   3.706    189

in DMSO-d6 (at 80.C)