124-11-8

壬烯(124-11-8)核磁圖(¹³CNMR)

產(chǎn)品名稱:壬烯

CAS:124-11-8

分子式:C9H18

分子量: 126.24

InChI:InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3H,1,4-9H2,2H3

InChIKey: JRZJOMJEPLMPRA-UHFFFAOYSA-N

Smiles:C=CCCCCCCC

Mass

MS-NW-4025          
1-nonene
C9H18               (Mass of molecular ion:    126)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      26.0       1.2
      27.0      21.1
      28.0       3.4
      29.0      30.2
      38.0       1.0
      39.0      21.8
      40.0       3.6
      41.0      69.0
      42.0      37.1
      43.0     100.0
      44.0       3.4
      51.0       1.5
      53.0       6.2
      54.0      11.1
      55.0      75.6
      56.0      86.1
      57.0      22.5
      58.0       1.0
      65.0       1.0
      67.0      10.5
      68.0       7.9
      69.0      40.8
      70.0      40.7
      71.0       6.2
      79.0       1.2
      81.0       4.8
      82.0       6.8
      83.0      24.1
      84.0      22.2
      85.0       4.3
      95.0       2.4
      96.0       3.1
      97.0      14.4
      98.0       7.5
     126.0       5.9

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₈	0.04 ml : 0.5 ml CDCl₃
1-nonene

    Assign.     Shift(ppm)

      A             5.79
      B             4.98
      C             4.92
      D             2.02
      E             1.45
      F             1.28
      G             0.89

     Hz     ppm     Int.

    541.50   6.047     32
    535.06   5.975     65
    531.56   5.936     39
    528.63   5.903     37
    525.13   5.864     81
    524.50   5.857     66
    518.69   5.792     49
    517.88   5.783    111
    514.44   5.745     61
    511.31   5.710     59
    508.00   5.673    129
    501.50   5.600     72
    457.13   5.105     52
    455.63   5.088    102
    454.69   5.077    108
    454.13   5.071     88
    453.25   5.061    197
    451.81   5.045    104
    447.56   4.998     89
    446.38   4.985    172
    445.19   4.971    136
    444.00   4.958     99
    442.81   4.945     56
    439.88   4.912     36
    438.44   4.896     61
    437.50   4.885    119
    436.13   4.870    217
    435.25   4.860    140
    434.69   4.854    124
    434.13   4.848     92
    432.88   4.834     37
    185.81   2.075     97
    179.25   2.002    122
    172.44   1.926     62
    115.00   1.285   1000
     98.00   1.095     33
     84.06   0.939    141
     78.94   0.882    424
     72.81   0.813     93

in CDCl3