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4-FERROCENYL-4-PHENYL-2-NITROBUTANE;MAJOR-ISOMER

View entire compound with spectra: 2 NMR

4-FERROCENYL-4-PHENYL-2-NITROBUTANE;MAJOR-ISOMER
SpectraBase Compound ID Af8B9AT8xrW
InChI InChI=1S/C10H12NO2.2C5H.Fe/c1-9(11(12)13)7-8-10-5-3-2-4-6-10;2*1-2-4-5-3-1;/h2-6,8-9H,7H2,1H3;2*1H;
InChIKey PJEFGFDJCIMEQJ-UHFFFAOYSA-N
Mol Weight 356.18 g/mol
Molecular Formula C20H14FeNO2
Exact Mass 356.03739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7gQbzBzHv8m
Name 4-FERROCENYL-4-PHENYL-2-NITROBUTANE;MAJOR-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H14FeNO2
InChI InChI=1S/C10H12NO2.2C5H.Fe/c1-9(11(12)13)7-8-10-5-3-2-4-6-10;2*1-2-4-5-3-1;/h2-6,8-9H,7H2,1H3;2*1H;
InChIKey PJEFGFDJCIMEQJ-UHFFFAOYSA-N
Literature Reference Author A.D.DILMAN,S.L.IOFFE,H.MAYR
Literature Reference Citation J.ORG.CHEM.,66,3196(2001)
Literature Reference DOI 10.1021/jo0015927
Molecular Weight 356.184 g/mol
Solvent CDCl3
Source File Reference UWMS28171