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110-06-5

叔丁基二硫(110-06-5)红外图谱(IR1)

产品名称:叔丁基二硫

CAS:110-06-5

分子式:C8H18S2

分子量: 178.36

InChI:InChI=1S/C8H18S2/c1-7(2,3)9-10-8(4,5)6/h1-6H3

InChIKey: BKCNDTDWDGQHSD-UHFFFAOYSA-N

Smiles:S(C(C)(C)C)SC(C)(C)C

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    Mass

    MS-NW-8334          
    di-tert-butyl disulfide
    C8H18S2             (Mass of molecular ion:    178)
    

       Source Temperature: 250 °C
       Sample Temperature: 130 °C
       Reservoir, 75 eV
    

          27.0       1.9
          28.0       1.0
          29.0      12.4
          39.0       3.1
          41.0      18.8
          55.0       1.5
          56.0       1.1
          57.0     100.0
          58.0       4.5
          59.0       1.2
         107.0       1.2
         122.0       9.1
         178.0       6.7
    

parameter in CDCl3

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    1H NMR 300 MHz
    C8 H18 S2 0.04 ml : 0.5 ml CDCl3
    di-tert-butyl disulfide
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 1.311

         Hz     ppm     Int.
    

        393.30   1.311   1000
    

in CDCl3

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CCl4 solution

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liquid film

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