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HEXACARBONYL-MY-[(1-4-ETA(4):1,4-ETA(2))-3-METHYL-1,2-DIPHENYL-1,3-BUTADIEN-1,4-DIYL]-DIIRON
SpectraBase Compound ID 4cyoxSbjpIC
InChI InChI=1S/C17H15.6CO.2Fe/c1-14(2)17(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15;6*1-2;;/h3-12H,1H2,2H3;;;;;;;;
InChIKey JUBKYOFZLDUCJF-UHFFFAOYSA-N
Mol Weight 499.06 g/mol
Molecular Formula C23H15Fe2O6
Exact Mass 498.956735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHXq6KlzUzA
Name HEXACARBONYL-MY-[(1-4-ETA(4):1,4-ETA(2))-3-METHYL-1,2-DIPHENYL-1,3-BUTADIEN-1,4-DIYL]-DIIRON
CAS Registry Number 122624-31-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H15Fe2O6
InChI InChI=1S/C17H15.6CO.2Fe/c1-14(2)17(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15;6*1-2;;/h3-12H,1H2,2H3;;;;;;;;
InChIKey JUBKYOFZLDUCJF-UHFFFAOYSA-N
Literature Reference Author R.AUMANN,H.D.MELCHERS,H.J.WEIDENHAUPT
Literature Reference Citation CHEM.BER.,123,351(1990)
Literature Reference DOI 10.1002/cber.19901230221
Molecular Weight 499.063 g/mol
Solvent CDCl3
Source File Reference UWCS17084