13688-67-0

1,10-十一碳二烯(13688-67-0)質(zhì)譜(MS)

產(chǎn)品名稱:1,10-十一碳二烯

CAS:13688-67-0

分子式:C11H20

分子量: 152.28

InChI:InChI=1S/C11H20/c1-3-5-7-9-11-10-8-6-4-2/h3-4H,1-2,5-11H2

InChIKey: VOSLXTGMYNYCPW-UHFFFAOYSA-N

Smiles:C=CCCCCCCCC=C

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-3703          
1,10-undecadiene
C11H20              (Mass of molecular ion:    152)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      26.0       1.0
      27.0      18.8
      28.0       2.4
      29.0      25.4
      39.0      27.3
      40.0       4.1
      41.0     100.0
      42.0      10.2
      43.0      15.0
      51.0       1.6
      53.0      10.1
      54.0      73.5
      55.0      99.5
      56.0      11.2
      57.0       8.0
      65.0       1.7
      66.0       4.3
      67.0      69.5
      68.0      44.1
      69.0      60.6
      70.0       6.1
      77.0       1.1
      79.0       2.5
      80.0       2.3
      81.0      50.0
      82.0      55.3
      83.0      12.3
      84.0       1.3
      94.0       1.0
      95.0      28.3
      96.0      23.4
      97.0       4.5
     109.0      11.3
     110.0       8.1
     111.0       1.9
     123.0       3.0
     124.0       5.8

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₁₁ H₂₀	0.04 ml : 0.5 ml CDCl₃
1,10-undecadiene

    Assign.     Shift(ppm)

      A             5.79
      B             4.98
      C             4.92
      D             2.04
      E             1.29

     Hz     ppm     Int.

    541.06   6.042     51
    534.56   5.969    105
    531.13   5.931     60
    528.06   5.897     57
    524.63   5.858    133
    524.00   5.851     93
    518.19   5.786     84
    517.38   5.777    171
    513.94   5.739     96
    510.81   5.704     92
    507.50   5.667    203
    501.00   5.595    114
    456.88   5.102     76
    455.38   5.085    162
    454.44   5.075    173
    453.94   5.069    125
    453.06   5.059    306
    451.56   5.042    153
    447.50   4.997    137
    446.31   4.984    275
    445.13   4.971    204
    443.94   4.957    148
    442.81   4.945     75
    439.63   4.909     49
    438.19   4.893    108
    437.63   4.887    156
    437.25   4.883    155
    436.38   4.873    308
    435.88   4.867    289
    435.19   4.860    212
    434.44   4.851    175
    432.81   4.833     46
    192.19   2.146     45
    191.50   2.139     46
    190.38   2.126     50
    185.75   2.075    151
    179.31   2.003    170
    173.13   1.934     69
    135.25   1.511     36
    130.44   1.457    106
    125.88   1.406     90
    115.88   1.294   1000
    111.06   1.241     68
    101.25   1.131     34

in CDCl3