133-06-2

Captan(133-06-2) MS

Product NameCaptan

CAS 133-06-2

Molecular FormulaC9H8Cl3NO2S

Molecular Weight300.59

InChIInChI=1S/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2

InChIKey LDVVMCZRFWMZSG-UHFFFAOYSA-N

SmilesC1(=O)C2C(CC=CC2)C(=O)N1SC(Cl)(Cl)Cl

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Captan(133-06-2) MS
Mass

MS2001-00748WA      
captan
C9H8Cl3NO2S         (Mass of molecular ion:    299)

   Source Temperature: 210 °C
   Sample Temperature:  25 °C
   Direct, 70 eV

      27.0       4.1
      39.0       7.3
      40.0       1.2
      41.0       2.3
      44.0       1.0
      50.0       2.0
      51.0       5.9
      52.0       4.6
      53.0       5.2
      54.0       1.7
      55.0       1.0
      65.0       3.3
      66.0       1.4
      67.0       2.0
      70.0       5.7
      72.0       1.1
      76.0       1.2
      77.0      27.3
      78.0      15.6
      79.0     100.0
      80.0      26.2
      81.0       3.8
      82.0       1.6
      84.0       1.0
      93.0       1.0
      95.0       1.2
     104.0       1.1
     105.0       5.2
     106.0       8.0
     107.0      17.5
     108.0       1.9
     111.0       2.4
     114.0       4.0
     116.0       2.8
     117.0      18.4
     119.0      17.5
     121.0       6.1
     122.0       1.3
     130.0       1.8
     132.0       1.2
     134.0       5.4
     136.0       1.4
     148.0       4.6
     149.0      47.2
     150.0       4.9
     151.0       1.7
     154.0       1.6
     156.0       7.3
     158.0       5.1
     160.0       1.0
     172.0       1.3
     180.0       1.8
     182.0       6.3
     236.0       5.5
     238.0       3.8
     263.0       9.8
     264.0      25.8
     265.0       9.5
     266.0      17.7
     267.0       3.2
     268.0       3.5
     299.0       4.1
     301.0       4.2
     303.0       1.5

in CDCl3