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XPPADQAKGWYANA-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

XPPADQAKGWYANA-UHFFFAOYSA-N
SpectraBase Compound ID WGAk192Cwv
InChI InChI=1S/C15H17P.C13H5.C9H9BN6.C5H.ClH.Fe.Ru/c1-13(2)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;1-2-11-7-9-13(10-8-11)12-5-3-4-6-12;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-2-4-5-3-1;;;/h3-13H,1-2H3;2,7-10H;1-9H;1H;1H;;
InChIKey XPPADQAKGWYANA-UHFFFAOYSA-N
Mol Weight 855.9 g/mol
Molecular Formula C42H33BClFeN6PRu
Exact Mass 856.067866 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID R8up8cTU4i
Name XPPADQAKGWYANA-UHFFFAOYSA-N
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H32BClFeN6PRu
InChI InChI=1S/C15H17P.C13H5.C9H9BN6.C5H.ClH.Fe.Ru/c1-13(2)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;1-2-11-7-9-13(10-8-11)12-5-3-4-6-12;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-2-4-5-3-1;;;/h3-13H,1-2H3;2,7-10H;1-9H;1H;1H;;
InChIKey XPPADQAKGWYANA-UHFFFAOYSA-N
Literature Reference Author S.PAVLIK,R.SCHMID,K.KIRCHNER,K.MEREITER
Literature Reference Citation MH.CHEM.,135,1349(2004)
Literature Reference DOI 10.1007/s00706-004-0222-6
Solvent CDCl3
Source File Reference UWMZ11972