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Back ChemicalBook Home>CAS DataBase List>499-44-5More Spectrum> Hinokitiol(499-44-5) IR1

499-44-5

Hinokitiol(499-44-5) IR1

Product NameHinokitiol

CAS499-44-5

Molecular FormulaC10H12O2

Molecular Weight164.2

InChIInChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)

InChIKey FUWUEFKEXZQKKA-UHFFFAOYSA-N

SmilesC1(=O)C=CC=C(C(C)C)C=C1O

  • Hinokitiol(499-44-5) IR1

  • Hinokitiol(499-44-5) IR1


        Assign.     Shift(ppm)
    
      A             9.05
      B          7.46 to 7.10
      C             6.95
      D             2.86
      E             1.272
     
     400MHZ : HSP-42-503
    Spectral Code: 1H NMR : 90 MHz in CDCl3

  • Hinokitiol(499-44-5) IR1


           ppm   Int.  Assign.
    
      171.37   517      1 *
      170.99   478      2 *
      159.96   413      3
      137.25   736      4
      127.63   706      5
      123.29   647      6 #
      122.29   701      7 #
       38.94   741      8
       23.39  1000      9
    Spectral Code: 13C NMR : in CDCl3

  • Hinokitiol(499-44-5) IR1

  • Hinokitiol(499-44-5) IR1

  • Hinokitiol(499-44-5) IR1

  • Hinokitiol(499-44-5) IR1

    Spectral Code: Raman : 4880 A,200 M,powder

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