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112-55-0

1-Dodecanethiol

Product Name 1-Dodecanethiol

CAS112-55-0

MFC12H26S

MW202.4

More

  • 112-55-0_ms
    Mass

    MS-NW-3864          
    1-dodecanethiol
    C12H26S             (Mass of molecular ion:    202)
    

       Source Temperature: 270 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          17.0       1.1
          18.0       5.1
          27.0      20.7
          28.0       3.9
          29.0      38.4
          30.0       1.0
          32.0       1.3
          34.0       1.2
          35.0       2.2
          39.0      14.6
          40.0       2.7
          41.0      78.6
          42.0      25.0
          43.0      97.2
          44.0       3.7
          45.0       4.6
          46.0       1.9
          47.0      20.9
          49.0       1.0
          53.0       5.5
          54.0      10.4
          55.0     100.0
          56.0      84.4
          57.0      77.8
          58.0       3.5
          59.0       1.7
          60.0       4.8
          61.0      14.2
          62.0       1.2
          66.0       1.1
          67.0      12.5
          68.0      32.1
          69.0      90.6
          70.0      79.0
          71.0      29.7
          72.0       1.6
          73.0       1.3
          75.0       1.2
          81.0       4.5
          82.0      28.5
          83.0      79.7
          84.0      50.9
          85.0      16.8
          86.0       1.1
          87.0       2.6
          88.0       3.4
          89.0      22.3
          90.0       1.3
          91.0       1.4
          95.0       1.6
          96.0      13.8
          97.0      54.9
          98.0      31.8
          99.0       3.8
         103.0       2.8
         110.0       4.0
         111.0      26.1
         112.0      16.5
         113.0       2.2
         124.0       1.6
         125.0       9.8
         126.0       7.2
         127.0       1.1
         138.0       1.1
         139.0       4.2
         140.0      14.0
         141.0       1.7
         168.0      24.6
         169.0       3.6
         201.0       2.8
         202.0      17.9
         203.0       2.9
         204.0       1.1
    

90 MHz in CDCl3

  • 112-55-0_1hnmr

    1H NMR 89.56 MHz
    C12 H26 S 0.04 ml : 0.5 ml CDCl3
    1-dodecanethiol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.505 B 1.60 C 1.306 D 1.26 E 0.883

         Hz     ppm     Int.
    

        229.06   2.558     51
        222.44   2.484     59
        214.56   2.396     31
        143.19   1.599     24
        136.50   1.525     32
        130.56   1.458     25
        128.63   1.437     32
        128.31   1.433     31
        128.00   1.430     32
        124.75   1.393    142
        116.94   1.306    192
        113.19   1.264   1000
        109.44   1.222    133
        103.88   1.160     24
         84.06   0.939     42
         81.81   0.914     35
         81.06   0.906     34
         78.81   0.880    130
         72.81   0.813     30
         72.69   0.812     30
    

in CDCl3

  • 112-55-0_13cnmr

liquid film

  • 112-55-0_ir1

  • 112-55-0_raman