5166-53-0

5-Methyl-3-hexen-2-one(5166-53-0) IR1

Product Name5-Methyl-3-hexen-2-one

CAS 5166-53-0

Molecular FormulaC7H12O

Molecular Weight112.17

InChIInChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3

InChIKey IYMKNYVCXUEFJE-UHFFFAOYSA-N

SmilesCC(=O)C=CC(C)C

Request For Quotation

¹HNMR

IR1

Raman

5-Methyl-3-hexen-2-one(5166-53-0) IR1
Mass

MS-NW-8806          
5-methyl-3-hexen-2-one
C7H12O              (Mass of molecular ion:    112)

   Source Temperature: 280 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       3.6
      18.0       1.9
      26.0       1.1
      27.0      10.1
      28.0       1.9
      29.0       3.1
      38.0       1.0
      39.0      12.1
      40.0       2.0
      41.0      82.0
      42.0       5.4
      43.0     100.0
      44.0       2.5
      50.0       1.3
      51.0       2.6
      52.0       1.2
      53.0       7.8
      54.0       2.2
      55.0      10.3
      58.0       1.7
      59.0       1.1
      65.0       1.0
      67.0       5.2
      68.0       2.8
      69.0      46.0
      70.0       7.1
      71.0       3.2
      77.0       1.6
      79.0       4.4
      81.0       1.3
      83.0       1.4
      97.0      51.0
      98.0       3.7
     111.0       1.4
     112.0      44.7
     113.0       4.6