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(2S,5S)-(2E,4Z)-Tricarbonyl[2-5.eta.11-chloro-2,4-undecadien-6-one]iron
SpectraBase Compound ID LEZ2VthOQDW
InChI InChI=1S/C11H13ClO.3CO.Fe/c1-2-3-5-8-11(13)9-6-4-7-10-12;3*1-2;/h4,6-7,9-10H2,1H3;;;;
InChIKey PRSBYWXVZJVFRE-UHFFFAOYSA-N
Mol Weight 336.55 g/mol
Molecular Formula C14H13ClFeO4
Exact Mass 335.985173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9nmYiQuZPu
Name (2S,5S)-(2E,4Z)-TRICARBONYL-[2-5-ETA-11-CHLORO-2,4-UNDECADIEN-6-ONE]-IRON
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13ClFeO4
InChI InChI=1S/C11H13ClO.3CO.Fe/c1-2-3-5-8-11(13)9-6-4-7-10-12;3*1-2;/h4,6-7,9-10H2,1H3;;;;
InChIKey PRSBYWXVZJVFRE-UHFFFAOYSA-N
Literature Reference Author Y.TAKEMOTO,J.TAKEUCHI,K.I.MORIO,T.NAKAMOTO,C.IWATA
Literature Reference Citation CHEM.PHARM.BULL.,44,940(1996)
Literature Reference DOI 10.1248/cpb.44.940
Molecular Weight 336.555 g/mol
Solvent CDCl3
Source File Reference UWLU31349