716-79-0

2-苯基苯并咪唑(716-79-0)核磁图(¹³CNMR)

产品名称:2-苯基苯并咪唑

CAS:716-79-0

分子式:C13H10N2

分子量: 194.23

InChI:InChI=1S/C13H10N2/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H,(H,14,15)

InChIKey: DWYHDSLIWMUSOO-UHFFFAOYSA-N

Smiles:C1(C2=CC=CC=C2)NC2=CC=CC=C2N=1

Mass

MS-NW-7030          
2-phenylbenzimidazole
C13H10N2            (Mass of molecular ion:    194)

   Source Temperature: 200 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      38.0       1.4
      39.0       2.8
      50.0       1.4
      51.0       3.1
      52.0       2.3
      62.0       1.5
      63.0       6.0
      64.0       5.8
      65.0       2.2
      76.0       1.8
      77.0       5.0
      83.5       1.4
      89.0       1.9
      90.0       5.9
      91.0       4.3
      96.5       2.3
      97.0       4.7
     103.0       1.4
     104.0       4.0
     140.0       1.0
     166.0       3.7
     167.0       3.6
     168.0       1.6
     192.0       3.4
     193.0      18.7
     194.0     100.0
     195.0      15.2
     196.0       1.2

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₃ H₁₀ N₂	0.042 g : 0.5 ml DMSO-d₆
2-phenylbenzimidazole

    Assign.     Shift(ppm)

      A            12.98
      B             8.246
      C             7.72
      D             7.58
      E             7.579
      F             7.515
      G             7.24

     Hz     ppm     Int.

   5187.18  12.980    278
   3300.56   8.259    614
   3299.07   8.255    811
   3296.93   8.250    219
   3291.80   8.237    789
   3290.95   8.235    617
   3288.60   8.229     98
   3089.44   7.731    120
   3087.73   7.727    118
   3083.67   7.716    132
   3037.73   7.601    317
   3036.45   7.598    478
   3034.74   7.594    268
   3029.40   7.581   1000
   3027.90   7.577    572
   3022.99   7.565    372
   3021.71   7.561    656
   3013.37   7.541     35
   3009.74   7.531    231
   3008.46   7.528    399
   3007.18   7.525    239
   3003.33   7.515    159
   3001.19   7.510    466
   2998.63   7.504    109
   2995.00   7.495     95
   2993.71   7.491    145
   2992.65   7.489     80
   2895.85   7.246    316
   2892.21   7.237    302

in DMSO-d6