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Major-isomer

View entire compound with spectra: 2 NMR

Major-isomer
SpectraBase Compound ID FC9m7C4vfLE
InChI InChI=1S/C17H11P.C11H11NO.2ClH.Fe.Pd/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;1-8(2)10-7-13-11(12-10)9-5-3-4-6-9;;;;/h1-6,9-13H;5,8,10H,7H2,1-2H3;2*1H;;/q;;;;;+1/p-1/t;10-;;;;/m.1..../s1
InChIKey OAAHMJXQGCVIGK-IDECYOGJSA-M
Mol Weight 653.64 g/mol
Molecular Formula C28H23Cl2FeNOPPd
Exact Mass 651.927848 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gm7grONUDeh
Name MINOR-ISOMER
Compound Number 25
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H22Cl2FeNOPPd
InChI InChI=1S/C17H11P.C11H11NO.2ClH.Fe.Pd/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;1-8(2)10-7-13-11(12-10)9-5-3-4-6-9;;;;/h1-6,9-13H;5,8,10H,7H2,1-2H3;2*1H;;/q;;;;;+1/p-1/t;10-;;;;/m.1..../s1
InChIKey OAAHMJXQGCVIGK-IDECYOGJSA-M
Literature Reference Author W.P.DENG,S.L.YOU,X.L.HOU,L.X.DAI,Y.H.YU,W.XIA,J.SUN
Literature Reference Citation J.AM.CHEM.SOC.,123,6508(2001)
Literature Reference DOI 10.1021/ja002657q
Solvent Unknown
Source File Reference UWVN27733