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1210-12-4

9-氰基蒽(1210-12-4)红外图谱(IR1)

产品名称:9-氰基蒽

CAS:1210-12-4

分子式:C15H9N

分子量: 203.24

InChI:InChI=1S/C15H9N/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H

InChIKey: KEQZHLAEKAVZLY-UHFFFAOYSA-N

Smiles:C1=C2C(C=C3C(=C2C#N)C=CC=C3)=CC=C1

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    Mass

    MS-NW-6200          
    9-anthracenecarbonitrile
    C15H9N              (Mass of molecular ion:    203)
    

       Source Temperature: 270 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          14.0       1.7
          18.0       4.2
          28.0       3.5
          50.0       1.1
          51.0       1.0
          62.0       1.1
          63.0       1.6
          74.0       2.2
          75.0       4.5
          76.0       1.1
          87.0       4.2
          87.5       2.4
          88.0       9.5
          88.5       2.3
          98.0       1.1
          99.0       1.2
         101.0       2.1
         101.5       7.5
         102.0       1.6
         149.0       1.4
         150.0       3.1
         151.0       1.8
         152.0       1.2
         174.0       3.0
         175.0       5.8
         176.0       6.9
         177.0       3.9
         201.0       7.1
         202.0       7.2
         203.0     100.0
         204.0      16.8
         205.0       1.7
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C15 H9 N 0.041 g : 0.5 ml CDCl3
    9-anthracenecarbonitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.55 B 8.328 C 7.980 D 7.66 E 7.51

         Hz     ppm     Int.
    

        765.31   8.546    564
        752.31   8.401    236
        751.44   8.391    411
        750.06   8.375    518
        749.19   8.366    417
        744.63   8.315    246
        743.06   8.297    389
        742.06   8.286    502
        741.63   8.281    593
        740.69   8.271    341
        721.19   8.053    241
        720.56   8.046    340
        719.56   8.035    366
        719.06   8.029    288
        718.06   8.018    259
        717.44   8.011    232
        712.94   7.961    579
        712.56   7.957    614
        711.31   7.943    439
        710.81   7.937    546
        710.06   7.929    386
        693.81   7.747    263
        692.19   7.729    369
        687.19   7.673    792
        685.56   7.655    606
        683.75   7.635    252
        682.63   7.623     72
        682.13   7.617     71
        680.63   7.600    666
        679.50   7.588   1000
        678.56   7.577    931
        677.13   7.561    607
        675.06   7.538     75
        674.00   7.526    256
        672.56   7.510    415
        671.13   7.494    459
        665.81   7.435    192
        664.44   7.419    158
    

in CDCl3

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KBr disc

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nujol mull

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