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(2S,4R)-2-FERROCENYL-3-PIVALOYL-4-[(E)-BUT-2-ENYL]-4-METHYL-1,3-OXAZOLIDIN-5-ONE
SpectraBase Compound ID 3YNrz0sKBRa
InChI InChI=1S/C18H24NO3.C5H5.Fe/c1-6-7-12-18(5)16(21)22-14(13-10-8-9-11-13)19(18)15(20)17(2,3)4;1-2-4-5-3-1;/h6-11,14H,12H2,1-5H3;1-5H;/b7-6+;;/t14-,18+;;/m0../s1
InChIKey DLYVVWUOBMOVOW-QEZZGZKKSA-N
Mol Weight 423.33 g/mol
Molecular Formula C23H29FeNO3
Exact Mass 423.14968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CveRFwmdg2O
Name (2S,4R)-2-FERROCENYL-3-PIVALOYL-4-[(E)-BUT-2-ENYL]-4-METHYL-1,3-OXAZOLIDIN-5-ONE
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H29FeNO3
InChI InChI=1S/C18H24NO3.C5H5.Fe/c1-6-7-12-18(5)16(21)22-14(13-10-8-9-11-13)19(18)15(20)17(2,3)4;1-2-4-5-3-1;/h6-11,14H,12H2,1-5H3;1-5H;/b7-6+;;/t14-,18+;;/m0../s1
InChIKey DLYVVWUOBMOVOW-QEZZGZKKSA-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 423.335 g/mol
Solvent CDCl3