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Back ChemicalBook Home>CAS DataBase List>5332-52-5More Spectrum> 1-UNDECANETHIOL(5332-52-5) MS

5332-52-5

1-UNDECANETHIOL(5332-52-5) MS

Product Name1-UNDECANETHIOL

CAS5332-52-5

Molecular FormulaC11H24S

Molecular Weight188.37

InChIInChI=1S/C11H24S/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3

InChIKey CCIDWXHLGNEQSL-UHFFFAOYSA-N

SmilesC(S)CCCCCCCCCC

  • 1-UNDECANETHIOL(5332-52-5) MS
    Mass

    MS-IW-7202          
    1-undecanethiol
    C11H24S             (Mass of molecular ion:    188)
    

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

          18.0       1.2
          27.0      18.0
          28.0       4.6
          29.0      35.5
          34.0       1.7
          35.0       2.6
          39.0      14.2
          40.0       2.7
          41.0      80.1
          42.0      33.1
          43.0      90.2
          44.0       3.8
          45.0       4.9
          46.0       2.0
          47.0      24.0
          48.0       1.0
          49.0       1.1
          53.0       5.8
          54.0      10.7
          55.0     100.0
          56.0      94.5
          57.0      76.9
          58.0       3.4
          59.0       2.2
          60.0       5.5
          61.0      17.9
          62.0       1.3
          65.0       1.0
          66.0       1.4
          67.0      15.5
          68.0      38.9
          69.0      99.8
          70.0      97.7
          71.0      30.0
          72.0       1.5
          73.0       1.4
          75.0       1.2
          79.0       1.2
          81.0       5.0
          82.0      37.8
          83.0      94.5
          84.0      76.2
          85.0      17.1
          87.0       2.8
          88.0       3.7
          89.0      25.7
          90.0       1.5
          91.0       1.4
          95.0       1.2
          96.0      18.7
          97.0      75.5
          98.0      36.8
          99.0       3.8
         101.0       1.0
         103.0       3.1
         110.0       4.5
         111.0      30.4
         112.0      16.6
         113.0       1.7
         124.0       2.7
         125.0      17.4
         126.0      25.6
         127.0       2.6
         154.0      39.8
         155.0       4.9
         187.0       4.1
         188.0      48.5
         189.0       7.1
         190.0       2.6
    

400 MHz in CDCl3

  • 1-UNDECANETHIOL(5332-52-5) MS

    1H NMR 399.65 MHz
    C11 H24 S 0.05 ml : 0.5 ml CDCl3
    1-undecanethiol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.514 B 1.603 C 1.37 D 1.316 E 1.26 F 0.880

         Hz     ppm     Int.
    

       1016.36   2.544    113
       1008.91   2.525    247
       1001.59   2.507    257
        994.14   2.488    124
        655.88   1.642     42
        648.93   1.624    105
        641.48   1.606    160
        634.03   1.587    118
        626.59   1.568     62
        556.40   1.393     71
        549.19   1.375     89
        541.99   1.357     73
        537.72   1.346     51
        534.06   1.337    180
        526.25   1.317    325
        518.55   1.298    289
        505.86   1.266   1000
        358.89   0.899    179
        352.29   0.882    469
        345.21   0.864    209
    

in CDCl3

  • 1-UNDECANETHIOL(5332-52-5) MS

liquid film

  • 1-UNDECANETHIOL(5332-52-5) MS

1-UNDECANETHIOL(5332-52-5) MS Atlas of Related Products

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