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6940-76-7

1-氯-3-碘丙烷(6940-76-7)质谱(MS)

产品名称:1-氯-3-碘丙烷

CAS:6940-76-7

分子式:C3H6ClI

分子量: 204.44

InChI:InChI=1S/C3H6ClI/c4-2-1-3-5/h1-3H2

InChIKey: SFOYQZYQTQDRIY-UHFFFAOYSA-N

Smiles:C(Cl)CCI

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    Mass

    MS-IW-8602          
    1-chloro-3-iodopropane
    C3H6ClI             (Mass of molecular ion:    204)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.1
          26.0       1.5
          27.0      13.3
          28.0       2.9
          36.0       1.3
          37.0       1.4
          38.0       2.8
          39.0      21.0
          40.0       3.1
          41.0      89.8
          42.0       5.4
          49.0      16.1
          51.0       5.4
          61.0       1.7
          75.0       2.4
          76.0       3.0
          77.0     100.0
          78.0       4.4
          79.0      33.7
          80.0       1.1
         127.0      11.8
         128.0       4.2
         141.0       5.5
         155.0       6.0
         169.0       3.6
         204.0      57.7
         205.0       1.9
         206.0      18.6
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C3 H6 Cl I 0.05 ml : 0.5 ml CDCl3
    1-chloro-3-iodopropane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.644 B 3.334 C 2.230

         Hz     ppm     Int.
    

       1462.65   3.660    593
       1460.69   3.655     58
       1456.54   3.645    916
       1450.44   3.630    602
       1447.39   3.622     29
       1338.99   3.351    599
       1332.40   3.334   1000
       1329.59   3.327     47
       1325.93   3.318    598
        903.56   2.261    186
        897.22   2.246    486
        895.14   2.240     52
        894.53   2.239     52
        890.99   2.230    601
        884.77   2.214    454
        878.30   2.198    164
    

in CDCl3

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liquid film

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