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JMNMJBUIXQNINL-GIZSFIMASA-N

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JMNMJBUIXQNINL-GIZSFIMASA-N
SpectraBase Compound ID 9sUQdccJZhh
InChI InChI=1S/C20H28O7.3CO.Fe/c1-4-26-19(23)18(20(24)27-5-2)17(14-10-6-7-11-14)15(21)12-8-9-13-16(22)25-3;3*1-2;/h8-9,12-14,17-18H,4-7,10-11H2,1-3H3;;;;/t17-;;;;/m1..../s1
InChIKey JMNMJBUIXQNINL-GIZSFIMASA-N
Mol Weight 520.31 g/mol
Molecular Formula C23H28FeO10
Exact Mass 520.103183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JJqDv7ZoWTI
Name JMNMJBUIXQNINL-GIZSFIMASA-N
Compound Number 18A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28FeO10
InChI InChI=1S/C20H28O7.3CO.Fe/c1-4-26-19(23)18(20(24)27-5-2)17(14-10-6-7-11-14)15(21)12-8-9-13-16(22)25-3;3*1-2;/h8-9,12-14,17-18H,4-7,10-11H2,1-3H3;;;;/t17-;;;;/m1..../s1
InChIKey JMNMJBUIXQNINL-GIZSFIMASA-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 520.316 g/mol
Solvent CDCl3
Source File Reference UWKP367