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返回ChemicalBook首页>CAS数据库列表>41480-75-5更多图谱> 2-二异丙基氨基乙烷硫醇盐酸盐(41480-75-5)红外图谱(IR1)

41480-75-5

2-二异丙基氨基乙烷硫醇盐酸盐(41480-75-5)红外图谱(IR1)

分子式:C8H20ClNS

分子量: 197.77

InChI:InChI=1S/C8H19NS.ClH/c1-7(2)9(5-6-10)8(3)4;/h7-8,10H,5-6H2,1-4H3;1H

InChIKey: UTPHRZRWMXLNIK-UHFFFAOYSA-N

Smiles:N(C(C)C)(C(C)C)CCS.Cl

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    Mass

    MS-NW-4546          
    2-(diisopropylamino)ethanethiol hydrochloride
    C8H19NS HCl         (Mass of molecular ion:    161)
    

       Source Temperature: 170 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          15.0       2.5
          17.0       4.6
          18.0      19.0
          26.0       1.3
          27.0      12.5
          28.0       6.6
          29.0       1.4
          30.0      43.1
          35.0       3.6
          36.0      19.6
          37.0       1.2
          38.0       6.6
          39.0       4.4
          41.0      13.9
          42.0      13.5
          43.0      20.6
          44.0      47.0
          45.0       4.5
          47.0       1.1
          54.0       1.4
          55.0       1.2
          56.0       6.8
          57.0       1.2
          58.0       7.7
          59.0       4.1
          60.0       3.9
          61.0       7.7
          68.0       1.5
          70.0      13.0
          71.0       1.9
          72.0      32.7
          73.0       1.9
          76.0       1.4
          82.0       1.3
          84.0       6.2
          85.0       1.4
          86.0      18.1
          87.0       1.2
          98.0       1.5
         100.0       1.2
         101.0       1.1
         102.0       1.7
         104.0       1.0
         106.0       1.2
         112.0       2.3
         114.0     100.0
         115.0       7.9
         118.0       2.1
         127.0       2.0
         128.0       3.0
         142.0       2.4
         144.0       3.8
         146.0       2.7
         157.0       2.1
         160.0       1.8
         161.0       1.1
         165.0       1.2
         193.0       2.0
         194.0       1.8
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C8 H19 N S 0.047 g : 0.5 ml CDCl3
    2-(diisopropylamino)ethanethiol hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 11.1 B 3.67 C 3.36 to 2.93 D 2.46 E *1 1.557 F *1 1.468

         Hz     ppm     Int.
    

        337.14   3.765     55
        332.78   3.716     60
        330.55   3.691     77
        328.33   3.667     36
        326.11   3.642     76
        324.13   3.620     63
        319.53   3.568     56
        317.94   3.551     31
        317.54   3.546     31
        306.91   3.427     40
        306.27   3.420     38
        294.61   3.290     30
        286.20   3.196    310
        277.00   3.093     37
        276.52   3.088     33
        228.28   2.549     31
        227.72   2.543     33
        227.25   2.538     32
        226.61   2.531     31
        220.34   2.461     48
        220.03   2.457     48
        142.74   1.594    873
        136.00   1.519    973
        134.73   1.505   1000
        131.08   1.464    139
        128.14   1.431    793
        123.22   1.376     31
    

in CDCl3

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KBr disc

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nujol mull

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