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Back ChemicalBook Home>CAS DataBase List>620-02-0More Spectrum> 5-Methyl furfural(620-02-0) MS

620-02-0

5-Methyl furfural(620-02-0) MS

Product Name5-Methyl furfural

CAS620-02-0

Molecular FormulaC6H6O2

Molecular Weight110.11

InChIInChI=1S/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3

InChIKey OUDFNZMQXZILJD-UHFFFAOYSA-N

SmilesO1C(C)=CC=C1C=O

  • 5-Methyl furfural(620-02-0) MS
    Mass

    MS-NW-1340          
    5-methyl-2-furaldehyde
    C6H6O2              (Mass of molecular ion:    110)
    

       Source Temperature: 260 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       3.3
          26.0       3.9
          27.0      22.6
          28.0       2.9
          29.0       5.9
          37.0       2.7
          38.0       4.2
          39.0      11.6
          41.0       1.0
          42.0       1.9
          43.0       9.8
          49.0       1.8
          50.0       7.8
          51.0      10.5
          52.0       6.0
          53.0      51.6
          54.0       4.9
          55.0       1.3
          79.0       1.8
          80.0       1.5
          81.0      10.3
          95.0       2.0
         109.0      78.9
         110.0     100.0
         111.0       7.0
    

90 MHz in CDCl3

  • 5-Methyl furfural(620-02-0) MS

    1H NMR 89.56 MHz
    C6 H6 O2 0.04 ml : 0.5 ml CDCl3
    5-methyl-2-furaldehyde
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.51 B 7.18 C 6.24 D 2.42

         Hz     ppm     Int.
    

        851.75   9.511    737
        644.63   7.198    205
        644.13   7.193    179
        641.13   7.159    221
        640.56   7.153    195
        561.44   6.269    157
        560.50   6.259    155
        559.63   6.249     65
        557.94   6.230    148
        557.00   6.220    143
        556.19   6.211     57
        217.38   2.428    857
        216.81   2.421   1000
        216.00   2.412    718
    

in CDCl3

  • 5-Methyl furfural(620-02-0) MS

CCl4 solution

  • 5-Methyl furfural(620-02-0) MS

liquid film

  • 5-Methyl furfural(620-02-0) MS

  • 5-Methyl furfural(620-02-0) MS

5-Methyl furfural(620-02-0) MS Atlas of Related Products

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