TETRAFLUOROBENZENE-1,3-DIOL(16840-25-8) MS

Product NameTETRAFLUOROBENZENE-1,3-DIOL

CAS 16840-25-8

Molecular FormulaC6H2F4O2

Molecular Weight182.07

InChIInChI=1S/C6H2F4O2/c7-1-2(8)5(11)4(10)6(12)3(1)9/h11-12H

InChIKey NLQBQVXMWOFCAU-UHFFFAOYSA-N

SmilesC1(O)=C(F)C(F)=C(F)C(O)=C1F

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IR1

IR2

Mass

MS-NW-1976          
tetrafluororesorcinol
C6H2F4O2            (Mass of molecular ion:    182)

   Source Temperature: 220 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      17.0       1.2
      18.0       5.2
      20.0       1.8
      28.0       3.4
      29.0       2.4
      31.0      11.8
      37.0       1.4
      44.0       1.1
      53.0       1.1
      55.0       3.5
      56.0       8.2
      57.0       2.2
      69.0       2.7
      71.0       4.9
      74.0       3.3
      75.0      13.5
      79.0       1.2
      82.0       1.1
      86.0       3.9
      87.0       5.0
      88.0       1.2
      91.0       4.4
      93.0       3.3
      95.0       1.2
      98.0       1.2
     105.0      16.5
     106.0      51.8
     107.0       3.1
     115.0       2.1
     117.0       2.9
     124.0       1.6
     133.0       2.7
     134.0      17.1
     135.0       1.5
     136.0       2.4
     137.0       1.1
     153.0       6.1
     161.0       1.1
     164.0       4.1
     181.0       2.0
     182.0     100.0
     183.0       6.8

CCl4 solution

KBr disc

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