350-29-8

3-Fluoro-4-hydroxybenzoic acid(350-29-8) IR2

Product Name3-Fluoro-4-hydroxybenzoic acid

CAS 350-29-8

Molecular FormulaC7H5FO3

Molecular Weight156.11

InChIInChI=1S/C7H5FO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)

InChIKey IUSDEKNMCOUBEE-UHFFFAOYSA-N

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

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3-Fluoro-4-hydroxybenzoic acid(350-29-8) IR2
Mass

MS-KW-0804          
3-fluoro-4-hydroxybenzoic acid hydrate
C7H5FO3 H2O         (Mass of molecular ion:    156)

   Source Temperature: 200 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      17.0       1.9
      18.0      10.4
      28.0       1.6
      31.0       2.5
      37.0       1.1
      38.0       1.4
      39.0       2.0
      45.0       1.8
      50.0       1.5
      51.0       2.7
      53.0       2.2
      55.0       3.1
      55.5       1.1
      56.0       1.5
      57.0      10.5
      61.0       1.7
      62.0       2.5
      63.0       4.9
      64.0       6.4
      69.5       2.3
      80.0       1.2
      81.0       2.9
      82.0       2.3
      83.0      16.2
      84.0       1.0
      99.0       1.3
     110.0       2.4
     111.0      25.9
     112.0       1.8
     127.0       1.0
     139.0     100.0
     140.0       7.9
     156.0      74.2
     157.0       6.0

in DMSO-d6