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JOFFXDBXBZQMBR-UHFFFAOYSA-N

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JOFFXDBXBZQMBR-UHFFFAOYSA-N
SpectraBase Compound ID 96jlhQVZx30
InChI InChI=1S/C11H11NO.3CO.Fe/c1-2-3-4-6-11-7-5-8-12(11)9-10-13;3*1-2;/h5,7-8,13H,9-10H2,1H3;;;;
InChIKey JOFFXDBXBZQMBR-UHFFFAOYSA-N
Mol Weight 313.09 g/mol
Molecular Formula C14H11FeNO4
Exact Mass 313.003744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6J9p7Wkcm7S
Name JOFFXDBXBZQMBR-UHFFFAOYSA-N
Compound Number 20F
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11FeNO4
InChI InChI=1S/C11H11NO.3CO.Fe/c1-2-3-4-6-11-7-5-8-12(11)9-10-13;3*1-2;/h5,7-8,13H,9-10H2,1H3;;;;
InChIKey JOFFXDBXBZQMBR-UHFFFAOYSA-N
Literature Reference Author I.WILLIAMS,B.M.KARIUKI,K.REEVES,L.R.COX
Literature Reference Citation ORG.LETTERS,8,4389(2006)
Literature Reference DOI 10.1021/ol061132l
Molecular Weight 313.093 g/mol
Sample ID 58177
Solvent CDCl3