3,5-Dichlorobenzoic acid(51-36-5) IR3

Product Name3,5-Dichlorobenzoic acid

CAS 51-36-5

Molecular FormulaC7H4Cl2O2

Molecular Weight191.01

InChIInChI=1S/C7H4Cl2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)

InChIKey CXKCZFDUOYMOOP-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC(Cl)=CC(Cl)=C1

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Mass

MS-NW-4802          
3,5-dichlorobenzoic acid
C7H4Cl2O2           (Mass of molecular ion:    190)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       1.6
      28.0       1.9
      36.0       2.4
      37.0       4.7
      38.0       2.3
      39.0       1.1
      44.0       1.1
      45.0       4.5
      49.0       2.5
      50.0       8.6
      51.0       2.2
      53.0       1.3
      54.5       2.9
      55.0       2.9
      55.5       1.1
      56.0       1.0
      60.0       1.0
      61.0       1.9
      62.0       1.7
      63.0       4.1
      72.0       1.2
      72.5       1.9
      73.0       7.0
      73.5       1.2
      74.0      19.5
      75.0      20.8
      76.0       1.8
      77.0       1.2
      84.0       4.0
      85.0       3.2
      86.0       1.6
      86.5       2.3
      87.0       1.4
      87.5       1.4
      98.0       1.0
      99.0       6.2
     101.0       2.2
     108.0       1.1
     109.0      15.6
     110.0       6.1
     111.0      11.5
     112.0       2.5
     113.0       2.5
     144.0       1.7
     145.0      35.1
     146.0       4.4
     147.0      22.0
     148.0       2.7
     149.0       3.7
     155.0       2.7
     162.0       1.4
     172.0       1.3
     173.0      77.2
     174.0       6.8
     175.0      48.7
     176.0       4.0
     177.0       8.2
     190.0     100.0
     191.0       8.3
     192.0      64.3
     193.0       5.3
     194.0      10.6