2216-45-7

4-Methylbenzyl acetate(2216-45-7) MS

Product Name4-Methylbenzyl acetate

CAS 2216-45-7

Molecular FormulaC10H12O2

Molecular Weight164.2

InChIInChI=1S/C10H12O2/c1-8-3-5-10(6-4-8)7-12-9(2)11/h3-6H,7H2,1-2H3

InChIKey WDCUPFMSLUIQBH-UHFFFAOYSA-N

SmilesC1(COC(=O)C)=CC=C(C)C=C1

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¹³CNMR

IR1

4-Methylbenzyl acetate(2216-45-7) MS
Mass

MS-NW-8391          
4-methylbenzyl acetate
C10H12O2            (Mass of molecular ion:    164)

   Source Temperature: 260 °C
   Sample Temperature: 140 °C
   Reservoir, 75 eV

      15.0       3.5
      18.0       1.6
      27.0       4.0
      28.0       2.5
      39.0       7.4
      41.0       1.8
      42.0       1.1
      43.0      36.9
      44.0       1.2
      45.0       2.6
      50.0       2.4
      51.0       7.1
      52.0       2.3
      53.0       2.3
      60.0       2.2
      62.0       1.2
      63.0       4.1
      64.0       1.0
      65.0       8.7
      75.0       3.1
      76.0       1.0
      77.0      21.5
      78.0      30.6
      79.0      16.1
      80.0       1.0
      89.0       2.8
      90.0       1.0
      91.0      15.5
      92.0       1.9
      93.0      13.4
      94.0       1.2
     102.0       1.6
     103.0      25.8
     104.0      73.6
     105.0      71.4
     106.0       6.5
     107.0      45.9
     108.0       3.6
     117.0       1.2
     119.0       3.7
     120.0       1.2
     121.0       6.3
     122.0     100.0
     123.0       8.8
     164.0      49.4
     165.0       5.5

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