133-49-3

PENTACHLOROTHIOPHENOL(133-49-3) IR3

Product NamePENTACHLOROTHIOPHENOL

CAS 133-49-3

Molecular FormulaC6HCl5S

Molecular Weight282.4

InChIInChI=1S/C6HCl5S/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H

InChIKey LLMLGZUZTFMXSA-UHFFFAOYSA-N

SmilesC1(S)=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl

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PENTACHLOROTHIOPHENOL(133-49-3) IR3
Mass

MS-NW-1613          
pentachlorobenzenethiol
C6HCl5S             (Mass of molecular ion:    280)

   Source Temperature: 210 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      18.0       2.6
      28.0       1.3
      32.0       1.4
      35.0       2.0
      36.0       4.6
      38.0       1.1
      44.0       1.8
      45.0       2.7
      47.0       3.2
      48.0       1.0
      49.0       1.0
      60.0       4.8
      61.0       1.5
      68.0       4.1
      69.0       1.3
      69.5       5.9
      70.0       1.3
      70.5       2.2
      71.0       5.0
      72.0       1.7
      73.0       1.5
      79.0      23.3
      80.0       1.3
      81.0       8.4
      83.0       1.6
      87.0       7.8
      88.0       5.3
      89.0       1.0
      91.0       1.1
      92.0       2.6
      95.0       7.8
      96.0       2.3
      97.0       2.7
     103.0      12.2
     104.0       3.6
     104.5       1.6
     105.0       8.6
     105.5       1.7
     106.0       5.1
     107.0       5.2
     108.0       1.7
     109.0       1.6
     115.0       2.5
     117.0       1.4
     118.0       2.5
     120.0       1.5
     122.0       8.3
     123.0      10.5
     123.5       1.1
     124.0       5.5
     125.0       1.4
     127.0       5.0
     129.0       1.9
     130.0       3.5
     131.0       2.5
     132.0       2.3
     133.0       1.6
     139.0      11.4
     140.0       6.5
     141.0      12.5
     142.0       9.7
     143.0       4.4
     144.0       3.6
     145.0       1.1
     165.0       5.7
     167.0       5.5
     169.0       1.8
     174.0       8.1
     175.0       3.0
     176.0       5.9
     177.0       3.8
     178.0       1.5
     179.0       2.1
     201.0       2.2
     203.0       2.8
     205.0       1.3
     209.0       8.3
     210.0      22.0
     211.0       9.8
     212.0      23.2
     213.0       4.8
     214.0       9.6
     215.0       1.4
     216.0       2.0
     237.0       1.5
     244.0      16.5
     245.0      47.4
     246.0      25.5
     247.0      63.5
     248.0      17.2
     249.0      33.4
     250.0       7.6
     251.0       8.4
     252.0       2.5
     253.0       1.1
     279.0       2.0
     280.0      62.6
     281.0       7.9
     282.0     100.0
     283.0       9.5
     284.0      66.8
     285.0       5.8
     286.0      23.5
     287.0       1.9
     288.0       4.3

CCl4 solution