87-88-7

Chloranilic acid(87-88-7) IR1

Product NameChloranilic acid

CAS 87-88-7

Molecular FormulaC6H2Cl2O4

Molecular Weight208.98

InChIInChI=1S/C6H2Cl2O4/c7-1-3(9)5(11)2(8)6(12)4(1)10/h9,12H

InChIKey IPPWILKGXFOXHO-UHFFFAOYSA-N

SmilesC1(=O)C(O)=C(Cl)C(=O)C(O)=C1Cl

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IR1

IR2

Chloranilic acid(87-88-7) IR1
Mass

MS-NW-1625          
2,5-dichloro-3,6-dihydroxy-p-benzoquinone
C6H2Cl2O4           (Mass of molecular ion:    208)

   Source Temperature: 190 °C
   Sample Temperature: 150 °C
   Direct, 75 eV

      12.0       2.5
      13.0       1.9
      14.0       1.2
      17.0       1.1
      18.0       4.4
      24.0       3.6
      25.0       3.8
      26.0       1.4
      28.0       9.6
      29.0      10.3
      35.0       4.0
      36.0      24.0
      37.0       3.6
      38.0       7.4
      40.0       7.9
      41.0      25.2
      42.0       4.7
      43.0       1.3
      44.0       6.3
      45.0       1.3
      47.0      15.2
      48.0       8.8
      49.0       5.6
      50.0       2.8
      52.0       6.8
      53.0       9.8
      54.0       1.5
      55.0       1.1
      57.0       1.6
      58.0       1.6
      59.0       2.5
      60.0       2.9
      61.0       3.3
      62.0       1.0
      63.0       2.3
      65.0       1.0
      68.0       7.5
      69.0      66.3
      70.0       4.3
      71.0       3.4
      72.0       3.5
      73.0       3.7
      74.0       1.2
      75.0       6.3
      76.0      29.7
      77.0      11.2
      78.0       8.9
      79.0       2.3
      82.0       1.3
      87.0      23.2
      88.0      15.5
      89.0      11.1
      90.0       5.1
      91.0       1.5
     100.0       1.5
     101.0       3.0
     103.0      20.9
     104.0       4.6
     105.0      27.4
     106.0       4.0
     107.0       7.9
     108.0       1.5
     111.0       2.3
     116.0       1.4
     117.0       5.1
     118.0       1.6
     119.0       1.9
     120.0       1.1
     123.0       3.0
     125.0       1.8
     127.0       5.1
     129.0       1.8
     144.0       4.1
     145.0      21.6
     146.0       3.5
     147.0       7.3
     152.0      11.3
     153.0       1.0
     154.0       7.4
     156.0       1.4
     162.0       1.6
     164.0       1.1
     172.0       3.7
     173.0      12.4
     174.0       8.8
     175.0       4.7
     176.0       2.7
     180.0      63.4
     181.0       3.8
     182.0      41.9
     183.0       2.4
     184.0       7.3
     208.0     100.0
     209.0       6.9
     210.0      64.4
     211.0       4.5
     212.0      11.3

KBr disc