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YFDGJHBHVVPSIE-UHFFFAOYSA-N
SpectraBase Compound ID DrEqg0Xf2xS
InChI InChI=1S/C15H18O7.3CO.Fe/c1-4-21-14(18)12(15(19)22-5-2)10-11(16)8-6-7-9-13(17)20-3;3*1-2;/h6-10H,4-5H2,1-3H3;;;;
InChIKey YFDGJHBHVVPSIE-UHFFFAOYSA-N
Mol Weight 450.18 g/mol
Molecular Formula C18H18FeO10
Exact Mass 450.024933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6jskqgr8QHh
Name YFDGJHBHVVPSIE-UHFFFAOYSA-N
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18FeO10
InChI InChI=1S/C15H18O7.3CO.Fe/c1-4-21-14(18)12(15(19)22-5-2)10-11(16)8-6-7-9-13(17)20-3;3*1-2;/h6-10H,4-5H2,1-3H3;;;;
InChIKey YFDGJHBHVVPSIE-UHFFFAOYSA-N
Literature Reference Author N.J.MARCHAND,D.M.GREE,J.T.MARTELLI,R.L.GREE,L.J.TOUPET
Literature Reference Citation J.ORG.CHEM.,61,5063(1996)
Literature Reference DOI 10.1021/jo9603643
Molecular Weight 450.182 g/mol
Solvent C6D6
Source File Reference UWKP345