誘蟲(chóng)烯(27519-02-4)紅外圖譜(IR1)

分子式:C23H46

分子量: 322.61

InChI:InChI=1S/C23H46/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-23H2,1-2H3/b19-17-

InChIKey: IGOWHGRNPLFNDJ-ZPHPHTNESA-N

Smiles:CCCCCCCC/C=C\CCCCCCCCCCCCC

Mass

MS-NW-5584          
cis-9-tricosene
C23H46              (Mass of molecular ion:    322)

   Source Temperature: 270 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      18.0       2.3
      27.0       8.7
      28.0       1.1
      29.0      25.7
      39.0       6.4
      40.0       1.5
      41.0      57.4
      42.0      11.8
      43.0      84.9
      44.0       2.9
      53.0       4.6
      54.0      19.8
      55.0      82.1
      56.0      45.7
      57.0     100.0
      58.0       5.3
      65.0       1.2
      66.0       2.1
      67.0      23.8
      68.0      17.0
      69.0      75.8
      70.0      46.8
      71.0      52.9
      72.0       3.2
      77.0       1.2
      79.0       3.8
      80.0       2.7
      81.0      16.9
      82.0      28.6
      83.0      90.8
      84.0      33.4
      85.0      33.0
      86.0       2.4
      93.0       1.2
      94.0       1.1
      95.0      11.2
      96.0      19.6
      97.0      81.4
      98.0      22.8
      99.0       9.9
     100.0       1.0
     109.0       5.7
     110.0       9.0
     111.0      43.8
     112.0      15.6
     113.0       6.3
     123.0       3.3
     124.0       6.1
     125.0      23.2
     126.0      10.4
     127.0       5.2
     137.0       1.8
     138.0       4.2
     139.0      10.6
     140.0       7.1
     141.0       3.3
     152.0       2.6
     153.0       6.6
     154.0       5.6
     155.0       2.4
     166.0       2.0
     167.0       4.8
     168.0       4.6
     169.0       2.0
     180.0       1.8
     181.0       2.9
     182.0       3.3
     183.0       1.2
     194.0       1.6
     195.0       2.2
     196.0       2.4
     197.0       1.5
     208.0       1.1
     209.0       1.6
     210.0       1.8
     211.0       1.1
     223.0       1.4
     224.0       1.6
     237.0       1.2
     238.0       1.2
     294.0       1.4
     320.0       1.8
     322.0      11.6
     323.0       3.0

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₂₃ H₄₆	0.04 ml : 0.5 ml CDCl₃
cis-9-tricosene

    Assign.     Shift(ppm)

      A             5.35
      B             2.01
      C             1.26
      D             0.88

     Hz     ppm     Int.

    478.75   5.346     48
    477.50   5.332     23
    474.38   5.297     23
    183.19   2.046     24
    182.88   2.042     25
    182.06   2.033     23
    177.81   1.986     27
    125.69   1.404     22
    125.19   1.398     23
    123.94   1.384     27
    121.56   1.358     35
    112.88   1.261   1000
     84.06   0.939     40
     81.63   0.912     34
     81.19   0.907     33
     80.75   0.902     33
     78.81   0.880    132
     72.69   0.812     29

in CDCl3