137-07-5

2-Aminobenzenethiol(137-07-5) Raman

Product Name2-Aminobenzenethiol

CAS 137-07-5

Molecular FormulaC6H7NS

Molecular Weight125.19

InChIInChI=1S/C6H7NS/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2

InChIKey VRVRGVPWCUEOGV-UHFFFAOYSA-N

SmilesC1(S)=CC=CC=C1N

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2-Aminobenzenethiol(137-07-5) Raman
Mass

MS-NW-3196          
o-aminobenzenethiol
C6H7NS              (Mass of molecular ion:    125)

   Source Temperature: 290 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       1.2
      27.0       1.1
      28.0       2.3
      37.0       1.1
      38.0       2.4
      39.0       5.5
      41.0       1.7
      45.0       5.0
      50.0       1.4
      51.0       2.4
      52.0       3.7
      53.0       5.9
      54.0       1.7
      58.0       1.2
      60.0       1.6
      61.5       1.9
      62.0       1.8
      62.5       3.4
      63.0       4.4
      64.0       2.6
      65.0       6.7
      66.0       3.4
      67.0       1.2
      69.0       4.4
      70.0       1.9
      71.0       1.3
      80.0      26.9
      81.0      12.5
      82.0       1.3
      84.0       1.9
      90.0       1.1
      91.0       2.5
      92.0       3.4
      93.0      21.8
      94.0       1.7
      95.0       1.4
      96.0       2.3
      97.0      12.9
      98.0       6.7
      99.0       2.6
     108.0       3.1
     124.0      25.0
     125.0     100.0
     126.0       8.9
     127.0       4.8
     248.0       2.4

90 MHz in CDCl3

2-Aminobenzenethiol(137-07-5) Raman

¹H NMR	89.56 MHz
C₆ H₇ N S	0.05 ml : 0.5 ml CDCl₃
o-aminobenzenethiol

    Assign.     Shift(ppm)

      A             7.304
      B             7.040
      C             6.64
      D             6.64
      E             3.68

     Hz     ppm     Int.

    659.56   7.365    457
    657.94   7.347    489
    657.50   7.342    453
    656.69   7.333    135
    654.38   7.307    134
    651.50   7.275    563
    650.31   7.262    623
    649.88   7.257    587
    640.44   7.151    311
    638.81   7.133    303
    632.81   7.066    568
    631.75   7.054    363
    630.69   7.043    459
    625.25   6.982    721
    623.63   6.964    618
    602.50   6.728    200
    600.94   6.710   1000
    599.44   6.694    986
    598.13   6.679    780
    596.63   6.662     54
    595.88   6.654     38
    594.81   6.642    423
    594.25   6.636    687
    593.31   6.625    511
    592.75   6.619    358
    591.88   6.609    488
    591.50   6.605    386
    590.38   6.593    367
    590.00   6.588    415
    587.19   6.557    409
    585.69   6.540    314
    329.94   3.685    203

in CDCl3