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1071-22-3

三氯-2-碳硅烷(1071-22-3)核磁图(13CNMR)

产品名称:三氯-2-碳硅烷

CAS:1071-22-3

分子式:C3H4Cl3NSi

分子量: 188.52

InChI:InChI=1S/C3H4Cl3NSi/c4-8(5,6)3-1-2-7/h1,3H2

InChIKey: OLBGECWYBGXCNV-UHFFFAOYSA-N

Smiles:C(#N)CC[Si](Cl)(Cl)Cl

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    Mass

    MS-IW-8616          
    3-(trichlorosilyl)propionitrile
    C3H4Cl3NSi          (Mass of molecular ion:    187)
    

       Source Temperature: 210 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          26.0       1.8
          27.0       3.4
          28.0       9.8
          36.0       3.2
          38.0       1.1
          49.0       1.9
          51.0       1.4
          52.0       2.3
          53.0       1.4
          54.0       9.7
          58.0       3.6
          63.0      20.2
          64.0       1.5
          65.0       7.5
          86.0       1.4
          98.0      14.6
          99.0       3.3
         100.0      10.0
         101.0       2.1
         102.0       2.0
         112.0       1.0
         124.0       6.2
         125.0       1.7
         126.0       4.3
         133.0      97.4
         134.0       5.1
         135.0      98.1
         136.0       4.9
         137.0      34.0
         138.0       1.6
         139.0       4.4
         147.0       2.2
         149.0       2.3
         151.0       1.9
         152.0       2.8
         153.0       1.2
         154.0       1.9
         160.0       6.0
         162.0       5.8
         164.0       2.0
         186.0      99.4
         187.0       9.5
         188.0     100.0
         189.0       9.1
         190.0      34.5
         191.0       3.1
         192.0       4.5
         266.0       1.3
         268.0       1.8
         270.0       1.0
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C3 H4 Cl3 N Si 0.048 g : 0.5 ml CDCl3
    3-(trichlorosilyl)propionitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.626 B 1.823

         Hz     ppm     Int.
    

       1061.89   2.658     51
       1058.11   2.648    856
       1053.10   2.636    242
       1051.15   2.631    520
       1050.05   2.628    913
       1048.34   2.624    425
       1046.51   2.619    238
       1041.87   2.607   1000
        741.21   1.855     43
        736.57   1.844    950
        731.81   1.832    239
        729.86   1.827    447
        728.39   1.823    867
        727.05   1.820    449
        725.22   1.815    213
        723.63   1.811     57
        720.34   1.803    856
        715.58   1.791     29
    

in CDCl3

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KBr disc

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nujol mull

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