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4-NITROPHENYL PHOSPHORODICHLORIDATE

Product Name 4-NITROPHENYL PHOSPHORODICHLORIDATE

CAS777-52-6

MFC6H4Cl2NO4P

MW255.98

¹³CNMR

Mass

MS-NW-7471          
p-nitrophenyl phosphorodichloridate
C6H4Cl2NO4P         (Mass of molecular ion:    255)

   Source Temperature: 170 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      18.0       2.8
      26.0       2.8
      28.0       4.9
      30.0      21.6
      36.0       3.1
      37.0       3.1
      38.0      14.2
      39.0       2.6
      47.0      13.5
      50.0      14.8
      51.0       5.3
      52.0       4.6
      53.0       2.6
      54.0       2.3
      61.0       3.1
      62.0       9.4
      63.0      40.9
      64.0      28.5
      65.0       1.7
      73.0       1.5
      74.0      10.2
      75.0     100.0
      76.0      13.4
      79.0       3.6
      80.0       3.3
      83.0       1.4
      91.0       1.7
      92.0      17.0
      93.0       1.2
      99.0      15.7
     101.0       5.3
     103.0       3.4
     107.0       4.1
     108.0       1.3
     111.0       8.1
     113.0       2.4
     117.0      24.1
     119.0      15.1
     121.0       2.4
     122.0       2.6
     127.0      21.9
     128.0       1.6
     129.0       7.0
     139.0       2.3
     173.0       1.3
     174.0       5.8
     176.0       1.9
     181.0       4.8
     183.0       3.0
     197.0       8.1
     199.0       5.9
     201.0       1.0
     209.0      16.8
     210.0       1.4
     211.0      11.3
     213.0       1.9
     220.0       6.3
     222.0       2.1
     225.0      43.3
     226.0       2.9
     227.0      28.1
     228.0       2.0
     229.0       4.9
     239.0       2.5
     241.0       1.6
     255.0      53.8
     256.0       4.1
     257.0      34.4
     258.0       2.5
     259.0       6.0

400 MHz in CDCl3

90 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₄ Cl₂ N O₄ P	0.036 g : 0.5 ml CDCl₃
p-nitrophenyl phosphorodichloridate

    Assign.     Shift(ppm)

      A             8.353
      B             7.514

     Hz     ppm     Int.

   3346.92   8.375    108
   3345.83   8.372    130
   3343.63   8.367    833
   3342.65   8.364    876
   3341.55   8.362    383
   3340.45   8.359    306
   3338.50   8.354     78
   3336.67   8.349    304
   3335.57   8.347    374
   3334.47   8.344    926
   3333.37   8.341    912
   3331.18   8.336    138
   3330.08   8.333    110
   3011.72   7.536    113
   3009.64   7.531    170
   3008.42   7.528    876
   3006.47   7.523   1000
   3004.27   7.518    297
   3001.34   7.510    287
   2999.27   7.505    950
   2997.31   7.500    825
   2995.97   7.497    166
   2994.02   7.492     94

¹H NMR	89.56 MHz
C₆ H₄ Cl₂ N O₄ P	0.045 g : 0.5 ml CDCl₃
p-nitrophenyl phosphorodichloridate

    Assign.     Shift(ppm)

      A             8.35
      B             7.51

     Hz     ppm     Int.

    753.13   8.410    789
    752.06   8.398    774
    750.75   8.383    342
    749.75   8.372    319
    746.06   8.331    393
    745.00   8.319    478
    743.69   8.304   1000
    742.63   8.292    867
    679.13   7.583    299
    677.88   7.570    964
    676.00   7.549    990
    673.63   7.522    321
    670.81   7.491    378
    668.88   7.469    740
    668.50   7.465    788
    666.56   7.443    692

in CDCl3

KBr disc

nujol mull

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