1HNMR)的核磁圖,紅外圖譜,Raman光譜,質(zhì)譜等圖譜" /> 1HNMR)" />

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873-74-5

對氨基苯腈(873-74-5)核磁圖(1HNMR)

產(chǎn)品名稱:對氨基苯腈

CAS:873-74-5

分子式:C7H6N2

分子量: 118.14

InChI:InChI=1S/C7H6N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,9H2

InChIKey: YBAZINRZQSAIAY-UHFFFAOYSA-N

Smiles:C(#N)C1=CC=C(N)C=C1

  • 圖譜
    Mass 

    MS-NW-1974          
p-aminobenzonitrile
C7H6N2              (Mass of molecular ion:    118)


       Source Temperature: 240 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV


          28.0       3.5
      37.0       2.3
      38.0       2.3
      39.0       3.7
      40.0       1.4
      41.0       4.3
      50.0       1.8
      51.0       1.6
      52.0       3.9
      54.0       1.0
      59.0       2.1
      62.0       2.0
      63.0       6.4
      64.0       9.1
      65.0       3.4
      66.0       1.1
      67.0       1.1
      75.0       1.1
      78.0       1.2
      90.0       6.8
      91.0      25.3
      92.0       2.4
     117.0       4.6
     118.0     100.0
     119.0       8.6

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C7 H6 N2 0.041 g : 0.5 ml CDCl3
    p-aminobenzonitrile
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.38
      B             6.65
      C             4.3
  

         Hz     ppm     Int.


        668.50   7.465     86
    666.13   7.438    777
    665.44   7.431    268
    664.06   7.415    242
    661.81   7.390     26
    659.38   7.363    255
    657.25   7.339   1000
    654.94   7.313    136
    601.44   6.716    115
    599.13   6.690    974
    597.00   6.666    269
    594.81   6.642     25
    592.31   6.614    217
    590.25   6.591    754
    587.88   6.565     87
    380.75   4.252     83

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

4880 A,200 M,powder

  • 圖譜

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