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(2S,4R)-2-Ferrocenyl-3-pivaloyl-4-cyanomethyl-4-methyl-1,3-oxazolidin-5-one
SpectraBase Compound ID 7iawhh6tluM
InChI InChI=1S/C16H19N2O3.C5H5.Fe/c1-15(2,3)13(19)18-12(11-7-5-6-8-11)21-14(20)16(18,4)9-10-17;1-2-4-5-3-1;/h5-8,12H,9H2,1-4H3;1-5H;/t12-,16+;;/m0../s1
InChIKey IYTZABBJJHHRGF-GWPSCLBYSA-N
Mol Weight 408.28 g/mol
Molecular Formula C21H24FeN2O3
Exact Mass 408.113629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpGu6QzLGYm
Name (2S,4R)-2-FERROCENYL-3-PIVALOYL-4-CYANOMETHYL-4-METHYL-1,3-OXAZOLIDIN-5-ONE
Compound Number 7H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24FeN2O3
InChI InChI=1S/C16H19N2O3.C5H5.Fe/c1-15(2,3)13(19)18-12(11-7-5-6-8-11)21-14(20)16(18,4)9-10-17;1-2-4-5-3-1;/h5-8,12H,9H2,1-4H3;1-5H;/t12-,16+;;/m0../s1
InChIKey IYTZABBJJHHRGF-GWPSCLBYSA-N
Literature Reference Author F.ALONSO,S.G.DAVIES,A.S.ELEND,J.L.HAGGITT
Literature Reference Citation J.CHEM.SOC.PERKIN-1,257(1998)
Literature Reference DOI 10.1039/a705764d
Molecular Weight 408.280 g/mol
Solvent CDCl3