505-32-8

Isophytol(505-32-8) IR2

Product NameIsophytol

CAS 505-32-8

Molecular FormulaC20H40O

Molecular Weight296.53

InChIInChI=1S/C20H40O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,17-19,21H,1,8-16H2,2-6H3

InChIKey KEVYVLWNCKMXJX-UHFFFAOYSA-N

SmilesC=CC(C)(O)CCCC(C)CCCC(C)CCCC(C)C

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Isophytol(505-32-8) IR2
Mass

MS-NW-0727          
3,7,11,15-tetramethyl-1-hexadecen-3-ol
C20H40O             (Mass of molecular ion:    296)

   Source Temperature: 160 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      27.0       3.9
      29.0       7.6
      39.0       2.6
      41.0      17.1
      42.0       3.6
      43.0      24.5
      51.0       1.0
      53.0       2.1
      55.0      15.6
      56.0       5.8
      57.0      18.7
      58.0       4.3
      59.0       2.4
      67.0       4.1
      68.0       5.1
      69.0      10.7
      70.0       4.3
      71.0     100.0
      72.0       6.1
      77.0       1.1
      79.0       1.2
      80.0       2.5
      81.0      10.3
      82.0      13.3
      83.0       7.6
      84.0       1.3
      85.0       4.2
      94.0       1.1
      95.0       8.4
      96.0       5.4
      97.0       5.5
      99.0       1.4
     109.0       4.1
     110.0       2.5
     111.0       3.5
     113.0       1.2
     123.0       8.2
     124.0       3.7
     125.0       2.1
     126.0       1.2
     137.0       2.0
     138.0       1.5
     141.0       1.7
     151.0       1.3
     152.0       1.6
     167.0       2.3
     168.0       4.1
     169.0       2.1
     179.0       1.0
     278.0       2.2