3-Bromo-4-fluorobenzoic acid(1007-16-5) MS

Product Name3-Bromo-4-fluorobenzoic acid

CAS 1007-16-5

Molecular FormulaC7H4BrFO2

Molecular Weight219.01

InChIInChI=1S/C7H4BrFO2/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,(H,10,11)

InChIKey ONELILMJNOWXSA-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC=C(F)C(Br)=C1

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Mass

MS2002-01312WA      
3-bromo-4-fluorobenzoic acid
C7H4BrFO2           (Mass of molecular ion:    218)

   Source Temperature: 250 °C
   Sample Temperature: 270 °C
   Reservoir, 70 eV

      18.0       1.1
      31.0       1.8
      37.0       2.7
      38.0       1.7
      39.0       1.0
      45.0       3.9
      47.0       2.4
      49.0       1.6
      50.0      10.9
      51.0       1.8
      53.0       1.1
      56.0       1.5
      57.0       4.6
      61.0       4.1
      62.0       3.9
      63.0       4.2
      68.0      10.8
      69.0       2.7
      73.0       3.4
      74.0      14.3
      75.0      10.9
      79.0       1.0
      81.0       2.4
      82.0       1.9
      83.0      10.3
      86.5       1.8
      87.5       1.7
      92.0       4.8
      93.0      13.0
      94.0      44.5
      95.0       9.2
     100.5       2.2
     101.5       2.1
     110.0       1.3
     121.0       1.1
     122.0       2.4
     172.0       1.1
     173.0      31.9
     174.0       3.2
     175.0      30.9
     176.0       2.1
     190.0       1.2
     192.0       1.1
     199.0       1.0
     201.0      76.3
     202.0       6.2
     203.0      73.7
     204.0       5.5
     217.0       1.2
     218.0     100.0
     219.0       8.5
     220.0      96.9
     221.0       7.2