Chinomethionate(2439-01-2) ¹H NMR

Product NameChinomethionate

CAS 2439-01-2

Molecular FormulaC10H6N2OS2

Molecular Weight234.3

InChIInChI=1S/C10H6N2OS2/c1-5-2-3-6-7(4-5)12-9-8(11-6)14-10(13)15-9/h2-4H,1H3

InChIKey FBQQHUGEACOBDN-UHFFFAOYSA-N

SmilesN1C2C(=CC(C)=CC=2)N=C2SC(=O)SC=12

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Mass

MS2001-00697WA      
chinomethionate
C10H6N2OS2          (Mass of molecular ion:    234)

   Source Temperature: 190 °C
   Sample Temperature:  25 °C
   Direct, 70 eV

      27.0       2.4
      32.0       1.4
      37.0       1.8
      38.0       3.0
      39.0       9.6
      40.0       1.0
      44.0       3.0
      45.0       5.1
      50.0       5.5
      51.0       8.6
      52.0       3.4
      58.0       2.4
      59.0       1.1
      60.0       2.7
      61.0       2.0
      62.0       5.3
      63.0      12.8
      64.0       7.4
      65.0       2.7
      69.0       2.6
      70.0       8.9
      71.0       1.3
      72.0       1.4
      74.0       2.4
      75.0       5.1
      76.0       6.3
      77.0       7.5
      78.0       2.8
      82.0       1.5
      83.0       2.4
      84.0       1.6
      86.0       1.6
      87.0       3.2
      88.0       7.9
      89.0      15.4
      90.0       5.4
      94.0       1.5
      95.0       2.0
      96.0       2.7
     102.0       4.7
     103.0       8.3
     104.0       4.4
     107.0       1.1
     108.0       1.5
     114.0       7.6
     115.0       8.1
     116.0      50.2
     117.0       4.6
     119.0       1.0
     120.0       3.0
     121.0       5.8
     122.0       2.1
     129.0       3.6
     130.0       1.7
     133.0       1.3
     134.0       1.3
     141.0       4.4
     142.0       5.2
     146.0       9.2
     147.0       5.5
     148.0      35.6
     149.0       3.8
     150.0       1.9
     161.0       2.1
     173.0      22.8
     174.0      25.7
     175.0       3.8
     176.0       1.3
     178.0       1.2
     205.0       9.3
     206.0     100.0
     207.0      12.6
     208.0       9.4
     209.0       1.1
     234.0      67.9
     235.0       9.0
     236.0       6.7
     240.0       1.0

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