John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JssSvUMSDk3 SpectraBase Spectrum ID=1jMuJl9sAda

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[FE-(DMPE)(2)-(CH3)-(C=CC6H5)];TRANS-ISOMER
SpectraBase Compound ID JssSvUMSDk3
InChI InChI=1S/C8H5.2C6H16P2.CH3.Fe/c1-2-8-6-4-3-5-7-8;2*1-7(2)5-6-8(3)4;;/h3-7H;2*5-6H2,1-4H3;1H3;/q;;;;-4/p+4
InChIKey FYNYDIBKMPXCLK-UHFFFAOYSA-R
Mol Weight 472.3 g/mol
Molecular Formula C21H40FeP4
Exact Mass 472.142994 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1jMuJl9sAda
Name [FE-(DMPE)(2)-(CH3)-(C=CC6H5)];CIS-ISOMER
Compound Number 1A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H40FeP4
InChI InChI=1S/C8H5.2C6H16P2.CH3.Fe/c1-2-8-6-4-3-5-7-8;2*1-7(2)5-6-8(3)4;;/h3-7H;2*5-6H2,1-4H3;1H3;/q;;;;-4/p+4
InChIKey FYNYDIBKMPXCLK-UHFFFAOYSA-R
Literature Reference Author L.D.FIELD,A.J.TURNBULL,P.TURNER
Literature Reference Citation J.AM.CHEM.SOC.,124,3692(2002)
Literature Reference DOI 10.1021/ja011105k
Solvent THF-D8
Source File Reference UWSI33634
SpectraBase Batch ID 6myf9efeaSY