5098-14-6

Aminomalononitrile p-toluenesulfonate(5098-14-6) Raman

Product NameAminomalononitrile p-toluenesulfonate

CAS 5098-14-6

Molecular FormulaC10H11N3O3S

Molecular Weight253.28

InChIInChI=1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2

InChIKey MEUWQVWJLLBVQI-UHFFFAOYSA-N

SmilesC1(S(=O)(=O)O)C=CC(C)=CC=1.C(N)(C#N)C#N

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Aminomalononitrile p-toluenesulfonate(5098-14-6) Raman
Mass

MS-IW-0058          
aminomalononitrile p-toluenesulfonate
C3H3N3 C7H8O3S      (Mass of molecular ion:    253)

   Source Temperature: 200 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      17.0       1.3
      18.0       6.3
      26.0       1.5
      27.0       6.5
      28.0      16.9
      29.0       2.5
      38.0       6.6
      39.0      15.1
      40.0       1.5
      41.0       3.4
      50.0       4.4
      51.0       6.5
      52.0       3.7
      53.0      19.3
      54.0      34.0
      55.0      30.9
      56.0       1.2
      61.0       1.0
      62.0       3.5
      63.0      10.3
      64.0       3.9
      65.0      37.7
      66.0       2.9
      74.0       1.2
      75.0       1.0
      77.0      15.0
      78.0       2.1
      79.0      17.1
      80.0      39.9
      81.0      24.3
      82.0       1.3
      89.0      11.9
      90.0      11.2
      91.0     100.0
      92.0       8.7
     107.0      46.0
     108.0      34.1
     109.0       2.7
     155.0       6.0
     172.0      89.6
     173.0       9.0
     174.0       5.1