41480-75-5

2-二异丙基氨基乙烷硫醇盐酸盐(41480-75-5)红外图谱(IR2)

产品名称:2-二异丙基氨基乙烷硫醇盐酸盐

CAS:41480-75-5

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

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

¹H NMR	89.56 MHz
C₈ H₁₉ N S	0.047 g : 0.5 ml CDCl₃
2-(diisopropylamino)ethanethiol hydrochloride

    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

KBr disc

nujol mull

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