1210-12-4

9-Anthrracenecarbonitrile(1210-12-4) MS

Product Name9-Anthrracenecarbonitrile

CAS 1210-12-4

Molecular FormulaC15H9N

Molecular Weight203.24

InChIInChI=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

SmilesC1=C2C(C=C3C(=C2C#N)C=CC=C3)=CC=C1

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9-Anthrracenecarbonitrile(1210-12-4) MS
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

9-Anthrracenecarbonitrile(1210-12-4) MS

¹H NMR	89.56 MHz
C₁₅ H₉ N	0.041 g : 0.5 ml CDCl₃
9-anthracenecarbonitrile

    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