609-99-4

3,5-Dinitrosalicylic acid(609-99-4) IR2

Product Name3,5-Dinitrosalicylic acid

CAS 609-99-4

Molecular FormulaC7H4N2O7

Molecular Weight228.12

InChIInChI=1S/C7H4N2O7/c10-6-4(7(11)12)1-3(8(13)14)2-5(6)9(15)16/h1-2,10H,(H,11,12)

InChIKey LWFUFLREGJMOIZ-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C1O

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3,5-Dinitrosalicylic acid(609-99-4) IR2
Mass

MS-NW-4776          
3,5-dinitrosalicylic acid
C7H4N2O7            (Mass of molecular ion:    228)

   Source Temperature: 190 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      17.0       1.0
      18.0       4.4
      28.0       3.9
      29.0       1.7
      30.0      19.3
      37.0       2.9
      38.0       3.6
      39.0       2.5
      44.0       2.2
      45.0       4.6
      46.0       1.1
      49.0       1.2
      50.0       8.0
      51.0       7.9
      52.0       3.2
      53.0      17.9
      54.0       1.5
      61.0       7.3
      62.0      24.5
      63.0      15.3
      64.0       5.2
      65.0       1.1
      66.0       7.5
      67.0       1.1
      68.0       1.5
      69.0       3.4
      74.0       1.3
      76.0       1.3
      77.0       4.2
      78.0       6.4
      79.0       5.4
      80.0       4.1
      89.0       1.1
      90.0      10.8
      91.0       7.5
      92.0       2.9
      94.0       2.3
      96.0       1.3
     105.0       1.3
     106.0       2.1
     107.0       2.0
     118.0      15.5
     119.0       3.3
     120.0       1.4
     123.0       1.5
     136.0       2.6
     137.0       1.3
     152.0      22.2
     153.0       1.6
     164.0       2.3
     165.0       1.8
     180.0       3.6
     194.0       7.1
     210.0     100.0
     211.0       9.5
     212.0       2.0
     228.0      48.5
     229.0       4.4