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DODECANOYLFERROCENE;MIXTURE_OF_ISOMERS
SpectraBase Compound ID EmuUVW6Fgt3
InChI InChI=1S/2C17H23O.2C5H.2Fe/c2*1-2-3-4-5-6-7-8-9-10-15-17(18)16-13-11-12-14-16;2*1-2-4-5-3-1;;/h2*2-10,15H2,1H3;2*1H;;
InChIKey PIZILVRGPVFMOY-UHFFFAOYSA-N
Mol Weight 720.56 g/mol
Molecular Formula C44H48Fe2O2
Exact Mass 720.235303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PFKRBuRNKH
Name DODECANOYLFERROCENE;MIXTURE_OF_ISOMERS
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H48Fe2O2
InChI InChI=1S/2C17H23O.2C5H.2Fe/c2*1-2-3-4-5-6-7-8-9-10-15-17(18)16-13-11-12-14-16;2*1-2-4-5-3-1;;/h2*2-10,15H2,1H3;2*1H;;
InChIKey PIZILVRGPVFMOY-UHFFFAOYSA-N
Literature Reference Author Y.OKADA,K.OGURI,K.SAKAMOTO,Y.MIYAKO,T.HAYASHI
Literature Reference Citation MAGN.RES.CHEM.,40,795(2002)
Literature Reference DOI 10.1002/mrc.1100
Molecular Weight 720.558 g/mol
Solvent Unknown
Source File Reference UWMZ21287