6434-77-1

CIS-2-NONENE(6434-77-1)質(zhì)譜(MS)

產(chǎn)品名稱:CIS-2-NONENE

CAS:6434-77-1

分子式:C9H18

分子量: 126.24

InChI:InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3,5H,4,6-9H2,1-2H3/b5-3-

InChIKey: IICQZTQZQSBHBY-HYXAFXHYSA-N

Smiles:C/C=C\CCCCCC

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-3501          
cis-2-nonene
C9H18               (Mass of molecular ion:    126)

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

      15.0       1.2
      26.0       1.5
      27.0      23.5
      28.0       2.3
      29.0      28.6
      38.0       1.3
      39.0      24.1
      40.0       4.5
      41.0      60.7
      42.0      30.8
      43.0      63.7
      44.0       2.0
      50.0       1.2
      51.0       2.4
      52.0       1.5
      53.0       9.9
      54.0      10.1
      55.0     100.0
      56.0      59.7
      57.0      13.4
      65.0       1.5
      67.0       7.7
      68.0       5.9
      69.0      40.1
      70.0      42.4
      71.0       9.5
      77.0       1.0
      81.0       1.3
      82.0       2.6
      83.0      14.6
      84.0      16.7
      85.0       3.0
      97.0      15.8
      98.0       5.3
     126.0      30.3
     127.0       3.2

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₈	0.04 ml : 0.5 ml CDCl₃
cis-2-nonene

    Assign.     Shift(ppm)

      A             5.45
      B             5.36
      C             2.01
      D             1.593
      E          1.51 to 1.09
      F             0.890

     Hz     ppm     Int.

    497.88   5.560     44
    497.38   5.554     34
    493.44   5.510     31
    492.31   5.497     79
    489.13   5.462     47
    488.00   5.449    309
    487.13   5.440    234
    486.63   5.434    264
    483.81   5.403    339
    482.75   5.391    592
    481.88   5.381    148
    481.38   5.375    161
    478.50   5.343    186
    477.69   5.334    172
    476.44   5.320     45
    473.06   5.283     46
    467.00   5.215     37
    184.00   2.055    119
    183.56   2.050    121
    183.25   2.047    121
    179.06   2.000    143
    173.50   1.938     66
    172.88   1.931     65
    170.94   1.909     43
    147.25   1.645     64
    146.38   1.635    361
    145.44   1.624    854
    144.56   1.615    628
    142.31   1.589    179
    141.44   1.580    582
    140.50   1.569    735
    139.63   1.560    401
    138.81   1.550    208
    132.69   1.482     32
    130.75   1.460     75
    129.63   1.448     64
    128.19   1.432     91
    125.81   1.405    107
    123.19   1.376    145
    116.75   1.304    918
    115.44   1.289    875
    114.38   1.278   1000
    103.38   1.155     55
    101.69   1.136     46
    101.19   1.130     45
    100.44   1.122     40
     98.94   1.105     33
     98.56   1.101     31
     98.19   1.097     30
     92.06   1.028     30
     84.63   0.945    187
     83.50   0.933    175
     81.63   0.912    161
     79.38   0.887    683
     73.25   0.818    134

in CDCl3