2-Acetylbenzoic acid(577-56-0) IR1

Product Name2-Acetylbenzoic acid

CAS 577-56-0

Molecular FormulaC9H8O3

Molecular Weight164.16

InChIInChI=1S/C9H8O3/c1-6(10)7-4-2-3-5-8(7)9(11)12/h2-5H,1H3,(H,11,12)

InChIKey QDAWXRKTSATEOP-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC=CC=C1C(C)=O

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Mass

MS-NW-6176          
2-acetylbenzoic acid
C9H8O3              (Mass of molecular ion:    164)

   Source Temperature: 250 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      15.0       2.2
      17.0       1.9
      18.0       7.4
      27.0       1.2
      28.0       1.2
      37.0       1.5
      38.0       2.4
      39.0       6.5
      42.0       1.4
      43.0      15.8
      44.0       3.1
      45.0       1.4
      49.0       1.0
      50.0      11.0
      51.0       8.1
      52.0       1.7
      53.0       1.3
      59.0       1.0
      62.0       1.5
      63.0       3.3
      64.0       1.4
      65.0      11.9
      66.0       1.4
      73.0       1.0
      74.0       4.6
      75.0       4.3
      76.0      14.7
      77.0      11.6
      78.0       3.2
      89.0       3.2
      90.0       6.5
      91.0       3.9
      93.0      11.0
     104.0      14.3
     105.0      17.2
     106.0       1.5
     118.0       3.5
     120.0       1.9
     121.0       8.8
     122.0       1.3
     144.0       4.1
     146.0      17.7
     147.0       4.6
     149.0     100.0
     150.0       9.3
     151.0       1.1
     164.0       1.0