ChemicalBook
English   Japanese   Germany   Korea

14850-23-8

反-4-辛烯(14850-23-8)Raman光谱

产品名称:反-4-辛烯

CAS:14850-23-8

分子式:C8H16

分子量: 112.21

InChI:InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h7-8H,3-6H2,1-2H3/b8-7+

InChIKey: IRUCBBFNLDIMIK-BQYQJAHWSA-N

Smiles:CCC/C=C/CCC

  • 图谱
    Mass

    MS-NW-3367          
    trans-4-octene
    C8H16               (Mass of molecular ion:    112)
    

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

          26.0       1.1
          27.0      15.9
          28.0       1.9
          29.0      14.2
          39.0      16.4
          40.0       2.5
          41.0      78.0
          42.0      25.2
          43.0      11.6
          50.0       1.1
          51.0       2.3
          52.0       1.1
          53.0       6.5
          54.0       7.2
          55.0     100.0
          56.0      43.4
          57.0      11.9
          65.0       1.5
          67.0       7.7
          68.0       3.8
          69.0      32.3
          70.0      42.3
          71.0       4.5
          77.0       1.2
          79.0       1.2
          81.0       2.0
          82.0       1.9
          83.0      28.8
          84.0       7.0
          97.0       1.4
         112.0      33.3
         113.0       3.2
    

90 MHz in CDCl3

  • 图谱

    1H NMR 89.56 MHz
    C8 H16 0.04 ml : 0.5 ml CDCl3
    trans-4-octene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 5.39 B 1.96 C 1.36 D 0.89 CONTAINS CIS ISOMER.

         Hz     ppm     Int.
    

        488.19   5.451     78
        486.56   5.433    162
        484.50   5.410    143
        482.94   5.393    256
        481.38   5.375    143
        479.31   5.352    172
        477.69   5.334     83
        185.75   2.075     64
        184.94   2.065     80
        183.13   2.045     56
        182.44   2.038     54
        178.63   1.995    166
        175.81   1.964    129
        173.31   1.936    169
        171.63   1.917    135
        170.81   1.908    116
        169.75   1.896    111
        167.19   1.867     98
        166.38   1.858     98
        140.81   1.573     36
        134.63   1.504     77
        132.94   1.485    139
        127.44   1.423    122
        126.38   1.412    172
        125.19   1.398    159
        122.81   1.372     40
        122.44   1.368     41
        119.63   1.336    173
        118.25   1.321    203
        115.13   1.286     36
        113.44   1.267     74
        111.56   1.246    163
        105.50   1.178     48
        104.88   1.172     48
         86.69   0.968    321
         85.88   0.959    550
         79.25   0.885   1000
         72.75   0.813    157
         71.69   0.801    261
         70.06   0.783    133
    

in CDCl3

  • 图谱

liquid film

  • 图谱

4880 A,200 M,liquid

  • 图谱

×