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Back ChemicalBook Home>CAS DataBase List>2050-77-3More Spectrum> 1-IODODECANE(2050-77-3) IR1

1-IODODECANE(2050-77-3) IR1

Product Name1-IODODECANE

CAS2050-77-3

Molecular FormulaC10H21I

Molecular Weight268.18

InChIInChI=1S/C10H21I/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3

InChIKey SKIDNYUZJPMKFC-UHFFFAOYSA-N

SmilesC(I)CCCCCCCCC


  • Mass

    MS-IW-0979          
    1-iododecane
    C10H21I             (Mass of molecular ion:    268)
    

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

          27.0       3.9
          29.0       7.9
          39.0       3.6
          41.0      23.5
          42.0       4.8
          43.0      74.8
          44.0       2.6
          53.0       1.3
          55.0      16.3
          56.0       4.7
          57.0      95.7
          58.0       5.0
          69.0       6.4
          70.0       2.7
          71.0      87.1
          72.0       5.0
          83.0       3.3
          85.0     100.0
          86.0       7.1
          97.0       1.2
          99.0      26.6
         100.0       2.1
         127.0       1.3
         128.0       2.7
         135.0       2.5
         137.0       2.5
         141.0      24.5
         142.0       2.8
         155.0       7.6
         169.0       1.3
         183.0       1.2
         268.0       3.9
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C10 H21 I 0.05 ml : 0.5 ml CDCl3
    1-iododecane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.18 B 1.82 C 1.27 D 0.89

         Hz     ppm     Int.
    

        292.25   3.264    114
        289.31   3.231     25
        288.56   3.222     28
        285.25   3.186    284
        281.69   3.146     25
        281.06   3.139     26
        278.25   3.107    166
        163.00   1.821     76
        114.25   1.276   1000
         84.06   0.939    103
         78.88   0.881    242
         72.88   0.814     67
    

in CDCl3



liquid film





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