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82105-88-2

(4-ETHOXYBENZYL)TRIPHENYLPHOSPHONIUM BROMIDE

Product Name (4-ETHOXYBENZYL)TRIPHENYLPHOSPHONIUM BROMIDE

CAS82105-88-2

MFC27H26BrOP

MW477.37

  • 82105-88-2_ms_1
    Mass

    MS-NW-7856          
    (p-ethoxybenzyl)triphenylphosphonium bromide
    C27H26BrOP          (Mass of molecular ion:    476)
    

       Source Temperature: 210 °C
       Sample Temperature: 220 °C
       Direct, 75 eV
    

          27.0       2.7
          29.0       2.3
          39.0       2.8
          50.0       1.5
          51.0       6.2
          52.0       3.3
          57.0       1.6
          63.0       1.7
          65.0       1.5
          77.0       8.0
          78.0       7.1
          79.0       1.4
          80.0       1.0
          81.0       1.2
          83.0       1.1
          89.0       2.5
          90.0       2.2
          91.0       1.1
         106.0       3.5
         107.0      45.3
         108.0      32.4
         109.0       2.8
         115.0       3.1
         128.0       1.2
         131.0       2.4
         133.0       3.0
         135.0      35.0
         136.0       4.2
         139.0       1.6
         141.0       1.4
         152.0       7.9
         153.0       2.0
         154.0       1.6
         157.0       3.8
         170.0       2.8
         181.0       1.4
         183.0      66.0
         184.0      14.2
         185.0      10.1
         186.0       1.3
         211.0       1.0
         214.0       1.8
         216.0       1.7
         240.0       1.5
         261.0      15.1
         262.0     100.0
         263.0      19.9
         264.0       1.9
    

400 MHz in CDCl3

90 MHz in CDCl3

  • 82105-88-2_1hnmr_2

    1H NMR 399.65 MHz
    C27 H26 Br O P 0.033 g : 0.5 ml CDCl3
    (p-ethoxybenzyl)triphenylphosphonium bromide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.781 B 7.70 C 7.65 D 6.980 E 6.634 F 5.192 G 3.929 J 1.362 J(B,P-31)=12.2HZ J(F,P-31)=13.6HZ

         Hz     ppm     Int.
    

       3119.51   7.806    165
       3118.16   7.803    159
       3117.43   7.801    177
       3115.72   7.797    126
       3112.18   7.788    420
       3111.21   7.785    364
       3110.23   7.783    446
       3106.08   7.773    172
       3104.74   7.769    315
       3103.27   7.765    301
       3101.56   7.761    165
       3086.91   7.725    431
       3079.71   7.707    765
       3078.37   7.703    670
       3076.17   7.698    303
       3074.58   7.694    396
       3067.63   7.676    849
       3066.04   7.672    787
       3064.21   7.668    662
       3060.30   7.658    675
       3056.76   7.649    667
       3053.22   7.640    657
       3048.83   7.629    296
       3045.17   7.620    226
       2795.78   6.996    238
       2793.21   6.990    270
       2786.99   6.974    306
       2784.42   6.968    274
       2655.15   6.644    404
       2646.97   6.624    358
       2082.03   5.210    391
       2068.48   5.176    389
       1581.05   3.957    130
       1574.10   3.939    430
       1567.14   3.922    436
       1560.06   3.904    138
        551.39   1.380    476
        544.43   1.363   1000
        537.48   1.345    461
    

  • 82105-88-2_1hnmr_1

    1H NMR 89.56 MHz
    C27 H26 Br O P 0.040 g : 0.5 ml CDCl3
    (p-ethoxybenzyl)triphenylphosphonium bromide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.74 to 7.64 B 6.970 C 6.635 D 5.179 E 3.919 F 1.361

         Hz     ppm     Int.
    

        706.38   7.888     53
        703.13   7.851     63
        700.38   7.821    150
        699.50   7.811    141
        697.69   7.791    183
        696.44   7.777    187
        693.19   7.740    758
        690.88   7.715    547
        684.31   7.641   1000
        681.75   7.613    293
        679.44   7.587    257
        675.13   7.539     51
        631.13   7.048     71
        628.75   7.021     79
        622.38   6.950    131
        619.81   6.921    123
        597.50   6.672    172
        589.06   6.578    107
        471.25   5.262    139
        457.50   5.109    142
        355.38   3.969    152
        348.44   3.891    163
        341.63   3.815     56
        128.63   1.437    178
        121.75   1.360    368
        114.69   1.281    150
    

in CDCl3

  • 82105-88-2_13cnmr_1

KBr disc

  • 82105-88-2_ir1_2

nujol mull

  • 82105-88-2_ir2_1