4708-04-7

1-丙基二氯化磷(4708-04-7)质谱(MS)

产品名称:1-丙基二氯化磷

CAS:4708-04-7

分子式:C3H7Cl2OP

分子量: 160.97

InChI:InChI=1S/C3H7Cl2OP/c1-2-3-7(4,5)6/h2-3H2,1H3

InChIKey: CWMQAFZROJAZQS-UHFFFAOYSA-N

Smiles:C(P(Cl)(Cl)=O)CC

Mass

MS-NW-7768          
propylphosphonic dichloride
C3H7Cl2OP           (Mass of molecular ion:    160)

   Source Temperature: 250 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       6.0
      18.0       1.1
      26.0       5.9
      27.0      49.7
      28.0       8.5
      29.0       6.0
      31.0       1.0
      35.0       1.7
      36.0       2.2
      37.0       2.2
      38.0       5.0
      39.0      35.5
      40.0       7.1
      41.0      70.8
      42.0      59.7
      43.0      83.6
      44.0       2.8
      45.0       1.8
      47.0      27.3
      48.0       1.6
      49.0       2.0
      56.0       1.0
      57.0       1.2
      61.0       1.3
      63.0       2.8
      65.0       1.0
      66.0       3.0
      67.0       1.0
      68.0       1.4
      82.0       2.1
      83.0       8.1
      85.0       3.1
      96.0       4.0
      97.0       9.9
      98.0       1.5
      99.0       3.3
     101.0       3.1
     103.0       2.1
     109.0       2.9
     111.0       1.0
     117.0       7.1
     118.0      16.3
     119.0       8.8
     120.0      10.8
     121.0       3.9
     122.0       1.9
     125.0       7.2
     127.0       2.6
     132.0     100.0
     133.0       1.4
     134.0      65.0
     135.0       1.0
     136.0      10.8
     145.0       2.3
     147.0       1.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₃ H₇ Cl₂ O P	0.05 ml : 0.5 ml CDCl₃
propylphosphonic dichloride

    Assign.     Shift(ppm)

      A             2.594
      B             1.905
      C             1.145

     Hz     ppm     Int.

   1052.49   2.634    326
   1047.85   2.622     95
   1046.63   2.619    167
   1044.68   2.614    280
   1042.48   2.609    147
   1041.26   2.606    127
   1037.84   2.597    355
   1036.74   2.595    407
   1033.08   2.585     94
   1031.86   2.582    164
   1030.03   2.578    276
   1027.83   2.572    139
   1026.49   2.569    117
   1022.09   2.558    354
   1020.26   2.553     92
    779.05   1.950    160
    771.48   1.931    204
    769.04   1.925    112
    763.31   1.910    225
    761.47   1.906    210
    755.74   1.892    210
    753.91   1.887    219
    748.41   1.873    120
    745.73   1.866    212
    738.28   1.848    155
    466.31   1.167    547
    463.99   1.161    547
    458.98   1.149    971
    456.54   1.143   1000
    451.54   1.130    528
    449.10   1.124    524

in CDCl3