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Back ChemicalBook Home>CAS DataBase List>619-99-8More Spectrum> 3-ETHYLHEXANE(619-99-8) IR1

619-99-8

3-ETHYLHEXANE(619-99-8) IR1

Product Name3-ETHYLHEXANE

CAS619-99-8

Molecular FormulaC8H18

Molecular Weight114.23

InChIInChI=1S/C8H18/c1-4-7-8(5-2)6-3/h8H,4-7H2,1-3H3

InChIKey SFRKSDZMZHIISH-UHFFFAOYSA-N

SmilesCCC(CC)CCC

  • 3-ETHYLHEXANE(619-99-8) IR1


        Assign.     Shift(ppm)
    
      A             1.28
      B             1.28
      C             1.21
      D             1.18
      E             0.884
      F             0.835
     
     J(A,E) = 7 HZ.
     J(B,F) = 7.4 HZ
    Spectral Code: 1H NMR : 90 MHz in CDCl3

  • 3-ETHYLHEXANE(619-99-8) IR1


           ppm   Int.  Assign.
    
       40.34   450      6
       35.37   583      5
       25.59  1000      4
       20.06   512      3
       14.55   526      2
       10.93   948      1
    Spectral Code: 13C NMR : in CDCl3

  • 3-ETHYLHEXANE(619-99-8) IR1

    Spectral Code: IR : liquid film

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