722-56-5

二苯基碘硝酸鹽(722-56-5)核磁圖(¹³CNMR)

產(chǎn)品名稱:二苯基碘硝酸鹽

CAS:722-56-5

分子式:C12H10INO3

分子量: 343.12

InChI:InChI=1S/C12H10I.NO3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2-1(3)4/h1-10H;/q+1;-1

InChIKey: CQZCVYWWRJDZBO-UHFFFAOYSA-N

Smiles:C1(=CC=CC=C1)[I+]C1=CC=CC=C1.[N+]([O-])([O-])=O

Mass

MS-IW-7585          
diphenyliodonium nitrate
C12H10INO3          (Mass of molecular ion:    343)

   Source Temperature: 170 °C
   Sample Temperature: 190 °C
   Direct, 75 eV

      27.0       1.0
      28.0       2.5
      30.0       1.8
      38.0       1.1
      39.0       2.6
      44.0       2.1
      50.0       7.1
      51.0      14.2
      52.0       1.2
      63.0       1.3
      64.0       1.2
      65.0       3.5
      74.0       2.8
      75.0       2.0
      76.0       2.8
      77.0      58.9
      78.0       4.7
      93.0       2.2
      94.0       2.2
     102.0       2.9
     108.0       1.2
     109.0       1.4
     123.0       3.9
     127.0       1.5
     139.0      10.5
     204.0     100.0
     205.0       6.5
     280.0       1.6

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₂ H₁₀ I N O₃	0.040 g : 0.5 ml DMSO-d₆
diphenyliodonium nitrate

    Assign.     Shift(ppm)

      A             8.270
      B             7.656
      C             7.529

     Hz     ppm     Int.

   3312.50   8.289    112
   3310.18   8.283    728
   3309.08   8.280    917
   3303.71   8.267    259
   3301.88   8.262    969
   3300.66   8.259    875
   3069.46   7.681    113
   3068.36   7.678    220
   3067.26   7.675    153
   3062.62   7.664    159
   3060.91   7.659    534
   3059.33   7.656    233
   3054.57   7.644    219
   3053.47   7.641    386
   3052.37   7.638    243
   3018.55   7.553    118
   3016.24   7.548    711
   3014.89   7.544    323
   3008.42   7.528   1000
   3002.56   7.513    198
   3000.98   7.510    524
   2998.90   7.504    133

in DMSO-d6