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(TRANS)-[PD(#2)(CH3)(4-CH3-PY)][PF6];MINOR-ISOMER

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(TRANS)-[PD(#2)(CH3)(4-CH3-PY)][PF6];MINOR-ISOMER
SpectraBase Compound ID AugVNbS06iK
InChI InChI=1S/C16H18N3P.C6H7N.CH3.F6P.Pd/c1-2-8-15(9-3-1)20-18-12-6-7-14(18)13-19(20)16-10-4-5-11-17-16;1-6-2-4-7-5-3-6;;1-7(2,3,4,5)6;/h1-5,8-11,14H,6-7,12-13H2;2-5H,1H3;1H3;;/q;;;-1;/p+1/t14-,20?;;;;/m0..../s1
InChIKey NKQHNWCRAAWPJM-FMNMYKDASA-O
Mol Weight 643.87194298 g/mol
Molecular Formula C23H29F6N4P2Pd
Exact Mass 643.080645 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3meZij84aoi
Name (CIS)-[PD(#2)(CH3)(4-CH3-PY)][PF6];MAJOR-ISOMER
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28F6N4P2Pd
InChI InChI=1S/C16H18N3P.C6H7N.CH3.F6P.Pd/c1-2-8-15(9-3-1)20-18-12-6-7-14(18)13-19(20)16-10-4-5-11-17-16;1-6-2-4-7-5-3-6;;1-7(2,3,4,5)6;/h1-5,8-11,14H,6-7,12-13H2;2-5H,1H3;1H3;;/q;;;-1;/p+1/t14-,20?;;;;/m0..../s1
InChIKey NKQHNWCRAAWPJM-FMNMYKDASA-O
Literature Reference Author L.FANFONI,A.MEDURI,E.ZANGRANDO,S.CASTILLON,F.FELLUGA,B.MILAN I
Literature Reference Citation MOLECULES,16,1804(2011)
Literature Reference DOI 10.3390/molecules16021804
Solvent CD2Cl2
Source File Reference UWIR41