872-05-9

正癸烯(872-05-9)質譜(MS)

產品名稱:正癸烯

CAS:872-05-9

分子式:C10H20

分子量: 140.27

InChI:InChI=1S/C10H20/c1-3-5-7-9-10-8-6-4-2/h3H,1,4-10H2,2H3

InChIKey: AFFLGGQVNFXPEV-UHFFFAOYSA-N

Smiles:C=CCCCCCCCC

Mass

MS-NW-0827          
1-decene
C10H20              (Mass of molecular ion:    140)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      27.0      23.5
      28.0       5.1
      29.0      37.5
      39.0      25.0
      40.0       4.0
      41.0      83.5
      42.0      35.0
      43.0      81.5
      44.0       2.7
      51.0       1.6
      53.0       7.2
      54.0      11.8
      55.0      87.7
      56.0     100.0
      57.0      69.3
      58.0       3.0
      65.0       1.1
      67.0       8.3
      68.0       9.8
      69.0      57.3
      70.0      80.7
      71.0      12.5
      81.0       1.9
      82.0       7.0
      83.0      33.7
      84.0      24.9
      85.0       5.7
      96.0       2.7
      97.0      21.7
      98.0      15.2
      99.0       1.4
     111.0      10.1
     112.0       7.2
     140.0      11.9
     141.0       1.4

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₁₀ H₂₀	0.04 ml : 0.5 ml CDCl₃
1-decene

    Assign.     Shift(ppm)

      A             5.79
      B             4.98
      C             4.92
      D             2.03
      E             1.41
      F             1.28
      G             0.89

     Hz     ppm     Int.

    535.06   5.975     51
    525.13   5.864     64
    524.38   5.856     45
    518.69   5.792     39
    517.88   5.783     83
    514.38   5.744     45
    511.31   5.710     46
    507.94   5.672     98
    501.50   5.600     55
    457.00   5.103     38
    455.56   5.087     83
    454.63   5.077     84
    454.06   5.070     62
    453.19   5.061    155
    451.75   5.045     77
    447.50   4.997     67
    446.31   4.984    136
    445.13   4.971    104
    443.94   4.957     76
    442.81   4.945     39
    438.38   4.895     47
    437.44   4.885     78
    436.38   4.873    148
    436.00   4.869    146
    435.19   4.860    104
    434.56   4.853     84
    434.06   4.847     62
    185.63   2.073     71
    184.94   2.065     68
    179.25   2.002     84
    174.88   1.953     35
    174.31   1.947     36
    173.75   1.941     38
    173.25   1.935     38
    172.75   1.929     38
    130.13   1.453     45
    129.63   1.448     46
    125.88   1.406     71
    125.38   1.400     72
    114.94   1.284   1000
    103.69   1.158     38
    101.81   1.137     30
     83.94   0.938    103
     81.63   0.912     84
     80.94   0.904     86
     78.94   0.882    321
     72.81   0.813     66

in CDCl3