2,2,4,4,6,8,8-HEPTAMETHYLNONANE(4390-04-9) ¹³C NMR

Product Name2,2,4,4,6,8,8-HEPTAMETHYLNONANE

CAS 4390-04-9

Molecular FormulaC16H34

Molecular Weight226.44

InChIInChI=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

SmilesCC(C)(C)CC(C)(C)CC(C)CC(C)(C)C

Request For Quotation

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

¹H NMR	89.56 MHz
C₁₆ H₃₄	0.04 ml : 0.5 ml CDCl₃
2,2,4,4,6,8,8-heptamethylnonane

    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