NEO-ALLOOCIMENE, STAB.(7216-56-0) IR1

Product NameNEO-ALLOOCIMENE, STAB.

CAS 7216-56-0

Molecular FormulaC10H16

Molecular Weight136.23

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Mass

MS-NW-8613          
(4E,6z)-2,6-dimethyl-2,4,6-octatriene
C10H16              (Mass of molecular ion:    136)

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

      27.0       8.6
      28.0       1.2
      29.0       7.3
      39.0      14.1
      40.0       2.2
      41.0      18.1
      42.0       1.0
      43.0       8.3
      50.0       1.3
      51.0       5.5
      52.0       2.6
      53.0       9.4
      54.0       1.2
      55.0       7.4
      63.0       2.3
      65.0       6.9
      66.0       1.9
      67.0       6.1
      68.0       2.0
      77.0      20.9
      78.0       4.3
      79.0      31.1
      80.0       3.9
      81.0       3.2
      91.0      27.0
      92.0       3.8
      93.0      23.1
      94.0       5.2
      95.0       1.6
     103.0       3.4
     104.0       1.1
     105.0      39.9
     106.0       9.9
     107.0       6.7
     119.0       7.5
     120.0       2.4
     121.0     100.0
     122.0      10.0
     136.0      47.2
     137.0       5.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₀ H₁₆	0.05 ml : 0.5 ml CDCl₃
(4E,6Z)-2,6-dimethyl-2,4,6-octatriene

    Assign.     Shift(ppm)

      A             6.298
      B             6.134
      C             5.858
      D             5.516
      E     *1      1.78
      F     *1      1.77
      G             1.724
     
     J(A,B)=15.3HZ, J(A,C)=10.8HZ

     Hz     ppm     Int.

   2531.74   6.335     67
   2521.00   6.309     78
   2516.48   6.297    106
   2505.74   6.270    120
   2457.76   6.150    185
   2442.50   6.112    122
   2347.66   5.875     85
   2346.31   5.871    109
   2345.46   5.869     94
   2336.79   5.848     78
   2335.57   5.845    101
   2334.72   5.842     85
   2214.84   5.542     33
   2207.89   5.525     94
   2200.81   5.507     96
   2193.73   5.490     35
    710.08   1.777    902
    708.62   1.774    918
    707.52   1.771    863
    706.30   1.768   1000
    705.20   1.765    924
    699.10   1.750     61
    692.63   1.734    444
    685.55   1.716    442

in CDCl3