John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CHGPscwBmgR SpectraBase Spectrum ID=2V2vs18W6NX

(accessed ).
TRICARBONYL-[(2,3,4,5-ETA)-2-METHOXYCYCLOHEXADIENE-1-ONE]-IRON(0)
SpectraBase Compound ID CHGPscwBmgR
InChI InChI=1S/C7H5O2.3CHO.Fe/c1-9-7-5-3-2-4-6(7)8;3*1-2;/h4H2,1H3;3*1H;
InChIKey OUMAIQQEYKERKC-UHFFFAOYSA-N
Mol Weight 264.01 g/mol
Molecular Formula C10H8FeO5
Exact Mass 263.972113 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2V2vs18W6NX
Name TRICARBONYL-[(2,3,4,5-ETA)-2-METHOXYCYCLOHEXADIENE-1-ONE]-IRON(0)
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H8FeO5
InChI InChI=1S/C7H5O2.3CHO.Fe/c1-9-7-5-3-2-4-6(7)8;3*1-2;/h4H2,1H3;3*1H;
InChIKey OUMAIQQEYKERKC-UHFFFAOYSA-N
Literature Reference Author G.R.STEPHENSON,I.M.PALOTAI,S.THOMAS,M.TINKL
Literature Reference Citation EUR.J.ORG.CHEM.,2013,1895(2013)
Literature Reference DOI 10.1002/ejoc.201201056
Molecular Weight 264.018 g/mol
Solvent CDCl3
Source File Reference UWBT20598
SpectraBase Batch ID 2eWCMhx5Wl0