CARYOPHYLLENE OXIDE

Mass

MS2018-05530CM      
beta-caryophyllene oxide
C15H24O             (Mass of molecular ion:    220)

   Source Temperature: 240 °C
   Sample Temperature:  20 °C
   Direct, 70 eV

      17.0       2.3
      18.0      10.0
      27.0       9.8
      28.0       2.4
      29.0      10.6
      39.0      21.6
      40.0       4.8
      41.0      70.7
      42.0       3.7
      43.0      61.4
      44.0       2.9
      45.0       1.9
      51.0       4.9
      52.0       3.8
      53.0      22.9
      54.0       4.9
      55.0      40.0
      56.0       5.3
      57.0       5.5
      58.0       2.7
      59.0       2.0
      63.0       1.5
      65.0      14.0
      66.0       6.5
      67.0      46.4
      68.0      13.8
      69.0      59.7
      70.0       5.7
      71.0      21.5
      72.0       2.0
      77.0      40.7
      78.0      13.5
      79.0     100.0
      80.0      19.9
      81.0      49.4
      82.0      25.9
      83.0      23.6
      84.0       5.6
      85.0       8.5
      91.0      72.4
      92.0      16.6
      93.0      97.8
      94.0      30.6
      95.0      62.9
      96.0      34.3
      97.0      10.5
      98.0       1.8
      99.0       1.3
     103.0       3.6
     104.0       3.2
     105.0      44.2
     106.0      47.8
     107.0      58.3
     108.0      24.0
     109.0      53.3
     110.0      34.8
     111.0      12.4
     112.0       1.6
     115.0       2.7
     116.0       1.4
     117.0       7.6
     118.0       4.7
     119.0      27.5
     120.0      26.2
     121.0      46.8
     122.0      14.9
     123.0      28.9
     124.0       6.6
     125.0       5.5
     126.0       2.1
     127.0       5.1
     128.0       3.0
     129.0       1.5
     131.0      16.3
     132.0       4.8
     133.0      19.3
     134.0      14.3
     135.0      21.5
     136.0      16.7
     137.0      11.5
     138.0      23.5
     139.0       4.3
     140.0       2.0
     145.0       8.6
     146.0       6.4
     147.0      15.6
     148.0       6.3
     149.0      19.4
     150.0       4.8
     151.0       8.6
     152.0       2.8
     153.0       1.1
     159.0      10.0
     160.0       3.3
     161.0      17.5
     162.0       6.3
     163.0      10.0
     164.0       9.2
     165.0       3.8
     173.0       2.6
     174.0       2.1
     175.0       2.1
     176.0       7.4
     177.0      14.1
     178.0       2.8
     187.0       9.1
     188.0       1.5
     189.0       1.8
     191.0       3.1
     192.0       3.0
     202.0       2.0
     205.0       7.1
     206.0       1.1
     220.0       3.9

Assign. Shift(ppm) A *1 4.976 B *1 4.859 C 2.878 D 2.618 E 2.339 F 2.249 G 2.11 J 2.10 K 1.764 L 1.69 M 1.65 N 1.62 O 1.426 P 1.327 Q 1.202 R *2 1.007 S *2 0.986 T 0.97 ASSIGNED BY H-H AND C-H COSY. J(C,F)=4.3HZ J(C,P)=10.6HZ J(D,K)=10.1HZ J(E,F)=4.3HZ J(E,G)=-12.6HZ J(E,P)=8.1HZ J(F,G)=12.6HZ J(F,P)=-12.3HZ J(G,P)=4.3HZ J(J,O)=4.2HZ J(J,T)=-13.2HZ J(K,M)=1.1HZ J(K,O)=10.5HZ J(M,T)=5.3HZ J(M,O)=-14.7HZ J(O,T)=13.4HZ

     Hz     ppm     Int.

   1989.38   4.978    145
   1988.16   4.975    152
   1942.87   4.862    168
   1942.02   4.860    146
   1941.16   4.858    156
   1157.71   2.897     75
   1153.44   2.887     81
   1147.09   2.871     81
   1142.82   2.860     82
   1050.90   2.630     53
   1042.36   2.609     55
   1032.59   2.584     33
    944.58   2.364     32
    936.28   2.343     59
    931.76   2.332     43
    928.10   2.323     33
    923.71   2.312     46
    905.88   2.267     30
    901.73   2.257     51
    897.46   2.246     45
    893.31   2.236     34
    889.77   2.227     40
    889.04   2.225     39
    857.79   2.147     45
    853.15   2.135     47
    849.85   2.127     39
    845.34   2.116     89
    842.16   2.108     68
    841.06   2.105     60
    838.62   2.099     47
    838.01   2.097     48
    832.76   2.084     61
    829.35   2.076     63
    825.93   2.067     38
    715.33   1.790     46
    705.20   1.765     86
    695.56   1.741     51
    684.45   1.713     44
    676.15   1.692     52
    675.66   1.691     52
    673.83   1.687    100
    670.41   1.678     34
    669.31   1.675     34
    665.53   1.666    122
    662.23   1.658     37
    661.13   1.655     35
    657.10   1.645     98
    654.54   1.638     48
    652.34   1.633     46
    650.88   1.629     58
    649.54   1.626     49
    646.48   1.618    150
    635.99   1.592     42
    577.88   1.446     37
    576.78   1.444     42
    573.85   1.436     33
    563.35   1.410     45
    547.61   1.371     31
    543.33   1.360     35
    539.55   1.351     33
    536.99   1.344     33
    535.16   1.340     55
    532.71   1.333     35
    530.64   1.328     33
    528.93   1.324     33
    527.22   1.320     33
    524.54   1.313     55
    522.58   1.308     31
    520.02   1.302     30
    480.71   1.203    738
    480.22   1.202    735
    402.71   1.008    802
    394.04   0.986   1000
    389.16   0.974     94
    384.03   0.961     69
    376.22   0.942     34