3658-77-3

Furaneol(3658-77-3) IR1

Product NameFuraneol

CAS 3658-77-3

Molecular FormulaC6H8O3

Molecular Weight128.13

InChIInChI=1S/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H3

InChIKey INAXVXBDKKUCGI-UHFFFAOYSA-N

SmilesO1C(C)=C(O)C(=O)C1C

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Furaneol(3658-77-3) IR1

    Assign.     Shift(ppm)

      A             7.
      B             4.508
      C             2.262
      D             1.451

Spectral Code: 1H NMR : 90 MHz in CDCl3

Furaneol(3658-77-3) IR1

       ppm   Int.  Assign.

      198.95   603      1
      175.14   598      2
      134.08  1000      3
       80.22   942      4
       16.42   698      5
       13.55   640      6

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : KBr disc

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