112-14-1

Acetic acid octyl ester(112-14-1) MS

Product NameAcetic acid octyl ester

CAS 112-14-1

Molecular FormulaC10H20O2

Molecular Weight172.26

InChIInChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-12-10(2)11/h3-9H2,1-2H3

InChIKey YLYBTZIQSIBWLI-UHFFFAOYSA-N

SmilesC(OCCCCCCCC)(=O)C

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Acetic acid octyl ester(112-14-1) MS
Mass

MS-NW-0709          
octyl acetate
C10H20O2            (Mass of molecular ion:    172)

   Source Temperature: 210 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       4.2
      18.0       1.2
      27.0      10.3
      28.0       6.5
      29.0      15.5
      31.0       1.1
      39.0       8.1
      40.0       1.6
      41.0      32.1
      42.0      25.2
      43.0     100.0
      44.0       3.1
      53.0       2.0
      54.0       3.5
      55.0      39.7
      56.0      51.0
      57.0      18.6
      58.0       3.5
      59.0       1.0
      61.0      36.9
      67.0       3.1
      68.0       9.7
      69.0      35.0
      70.0      50.1
      71.0       9.3
      73.0       8.4
      81.0       1.3
      82.0       8.0
      83.0      31.3
      84.0      38.5
      85.0       3.0
      87.0       1.3
      97.0       3.5
      98.0       3.0
     101.0       2.1
     111.0       1.5
     112.0      20.5
     113.0       2.2
     116.0       4.2