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Back ChemicalBook Home>CAS DataBase List>12180-80-2More Spectrum> 1,1'-DIBENZOYLFERROCENE(12180-80-2) 1H NMR

12180-80-2

1,1'-DIBENZOYLFERROCENE(12180-80-2) 1H NMR

Molecular FormulaC24H18FeO210*

Molecular Weight394.24

InChIInChI=1S/2C12H9O.Fe/c2*13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;/h2*1-9H;

InChIKey HAAYOEOQZIDZLZ-UHFFFAOYSA-N

Smiles[C]1([CH][CH][CH][CH]1)C(=O)C1C=CC=CC=1.[C]1([CH][CH][CH][CH]1)C(=O)C1=CC=CC=C1.[Fe] |^1:0,1,2,3,4,13,14,15,16,17|

  • 1,1'-DIBENZOYLFERROCENE(12180-80-2) <sup>1</sup>H NMR


        Assign.     Shift(ppm)
    
     A          7.775
     B          7.605
     C          7.496
     D          4.856
     E          4.713

     Assigned with HMQC and HMBC.
    Spectral Code: 1H NMR : in DMSO-d6

  • 1,1'-DIBENZOYLFERROCENE(12180-80-2) <sup>1</sup>H NMR


           ppm   Int.  Assign.
    
      197.94    98      1
      139.15   201      2
      131.98   506      3
      128.41  1000      4 *
      128.18   884      5 *
       79.62   183      6
       74.79   713      7 #
       73.26   744      8 #
    Spectral Code: 13C NMR : in CDCl3

  • 1,1'-DIBENZOYLFERROCENE(12180-80-2) <sup>1</sup>H NMR

    Spectral Code: IR : KBr disc

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