1148-79-4

α，α，α-三联吡啶(1148-79-4)核磁图(¹HNMR)

产品名称:α，α，α-三联吡啶

CAS:1148-79-4

分子式:C15H11N3

分子量: 233.27

InChI:InChI=1S/C15H11N3/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13/h1-11H

InChIKey: DRGAZIDRYFYHIJ-UHFFFAOYSA-N

Smiles:C1(C2=NC(C3=NC=CC=C3)=CC=C2)=NC=CC=C1

Mass

MS-KW-0506          
2,2':6',2''-terpyridine
C15H11N3            (Mass of molecular ion:    233)

   Source Temperature: 150 °C
   Sample Temperature: 100 °C
   Direct, 75 eV

      50.0       1.4
      51.0       4.2
      52.0       1.9
      75.0       1.3
      76.0       2.0
      77.0       1.3
      78.0       9.0
      79.0       2.2
      89.0       1.2
     101.0       1.4
     102.0       1.8
     103.0       7.1
     103.5       1.8
     115.5       1.0
     116.5       9.2
     117.0       1.7
     128.0       3.8
     129.0       2.2
     130.0       1.6
     131.0       1.2
     155.0      10.9
     156.0       1.8
     205.0      14.0
     206.0       5.7
     207.0       3.6
     230.0       1.5
     231.0       2.5
     232.0      33.2
     233.0     100.0
     234.0      17.1
     235.0       1.4

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₁₅ H₁₁ N₃	0.042 g : 0.5 ml CDCl₃
2,2':6',2''-terpyridine

    Assign.     Shift(ppm)

      A             8.68
      B             8.61
      C             8.45
      D             7.93
      E             7.83
      F             7.30

     Hz     ppm     Int.

    781.69   8.729    269
    780.81   8.719    363
    779.88   8.708    338
    778.94   8.698    336
    776.94   8.676    284
    776.00   8.665    590
    775.63   8.661    589
    774.25   8.646    806
    773.38   8.636    291
    767.63   8.572    411
    766.63   8.560    585
    765.44   8.547    353
    761.44   8.503    589
    760.69   8.494    575
    753.44   8.413   1000
    717.88   8.016    432
    710.75   7.937    349
    709.38   7.921    496
    707.31   7.898    310
    702.25   7.842    406
    701.69   7.835    528
    699.75   7.814    483
    693.75   7.747    324
    691.88   7.726    322
    659.75   7.367    377
    658.44   7.352    371
    655.00   7.314    340
    653.69   7.299    356
    652.25   7.283    296
    650.94   7.269    343
    647.50   7.230    271
    646.25   7.216    241

in CDCl3