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4390-04-9

七甲基壬烷(4390-04-9)核磁圖(1HNMR)

產(chǎn)品名稱:七甲基壬烷

CAS:4390-04-9

分子式:C16H34

分子量: 226.44

InChI:InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3

InChIKey: VCLJODPNBNEBKW-UHFFFAOYSA-N

Smiles:CC(C)(C)CC(C)(C)CC(C)CC(C)(C)C

  • 圖譜
    Mass 

    MS-NW-4582          
2,2,4,4,6,8,8-heptamethylnonane
C16H34              (Mass of molecular ion:    226)


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


          27.0       1.2
      29.0       4.2
      39.0       1.8
      41.0       9.3
      43.0       7.2
      55.0       3.9
      56.0       6.1
      57.0     100.0
      58.0       4.6
      69.0       1.8
      71.0      10.0
      83.0       2.4
      85.0       8.5
      97.0       1.6
      98.0       3.2
      99.0       8.8
     112.0       2.8
     113.0       7.4
     155.0       1.4

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C16 H34 0.04 ml : 0.5 ml CDCl3
    2,2,4,4,6,8,8-heptamethylnonane
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             1.260
      B          1.21 to 1.10
      C             0.980
      D             0.91
  

         Hz     ppm     Int.


        112.88   1.261    146
    110.50   1.234     38
    108.63   1.213     50
    107.06   1.196     27
    104.88   1.172     40
    102.31   1.143     27
     97.56   1.090     28
     87.88   0.982   1000
     83.38   0.931     39
     81.44   0.910    885
     79.88   0.892     88
     79.44   0.888     84

in CDCl3

  • 圖譜

liquid film

  • 圖譜

  • 圖譜

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