For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[(ETA-(5)-C5H5)-(ETA-(5)-C5H4-(CH2)4-PPH2)_TICL2]
SpectraBase Compound ID F5h6329roSF
InChI InChI=1S/C21H21P.C5H3.2ClH.Ti/c1-3-14-20(15-4-1)22(21-16-5-2-6-17-21)18-10-9-13-19-11-7-8-12-19;1-2-4-5-3-1;;;/h1-8,11,14-17H,9-10,13,18H2;1-2,5H;2*1H;/q;;;;+2/p-2
InChIKey IBXOVBOPWZAJCG-UHFFFAOYSA-L
Mol Weight 486.22 g/mol
Molecular Formula C26H24Cl2PTi
Exact Mass 485.047209 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID L4sJdajv0Na
Name [(ETA-(5)-C5H5)-(ETA-(5)-C5H4-(CH2)4-PPH2)_TICL2]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H24Cl2PTi
InChI InChI=1S/C21H21P.C5H3.2ClH.Ti/c1-3-14-20(15-4-1)22(21-16-5-2-6-17-21)18-10-9-13-19-11-7-8-12-19;1-2-4-5-3-1;;;/h1-8,11,14-17H,9-10,13,18H2;1-2,5H;2*1H;/q;;;;+2/p-2
InChIKey IBXOVBOPWZAJCG-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 CDCl3
Source File Reference UWMZ40503