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[(ETA-(5)-C5H5)-(ETA-(5)-C5H4-(CME2)-P(H)PH)_TICL2]
SpectraBase Compound ID 4GR7Jz8zdKD
InChI InChI=1S/C14H15P.C5H3.2ClH.Ti/c1-14(2,12-8-6-7-9-12)15-13-10-4-3-5-11-13;1-2-4-5-3-1;;;/h3-8,10-11,15H,1-2H3;1-2,5H;2*1H;/q;;;;+2/p-2
InChIKey LMAVSESDSPVAPW-UHFFFAOYSA-L
Mol Weight 396.1 g/mol
Molecular Formula C19H18Cl2PTi
Exact Mass 395.000259 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzYBP3MkQBS
Name [(ETA-(5)-C5H5)-(ETA-(5)-C5H4-(CME2)-P(H)PH)_TICL2]
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18Cl2PTi
InChI InChI=1S/C14H15P.C5H3.2ClH.Ti/c1-14(2,12-8-6-7-9-12)15-13-10-4-3-5-11-13;1-2-4-5-3-1;;;/h3-8,10-11,15H,1-2H3;1-2,5H;2*1H;/q;;;;+2/p-2
InChIKey LMAVSESDSPVAPW-UHFFFAOYSA-L
Literature Reference Author F.PELLETIER,V.COMTE,A.MASSARD,M.WENZEL,S.TOULOT,P.RICHARD,M. PICQUET,P.LEGENDRE,O
Literature Reference Citation J.MED.CHEM.,53,6923(2010)
Literature Reference DOI 10.1021/jm1004804
Solvent C6D6
Source File Reference UWMZ40504