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[[(ETA(5)-C5H5)-(PPH3)(2)-RU]=C=C(PH)-CH2COOME]-[PF6]

View entire compound with spectra: 2 NMR

[[(ETA(5)-C5H5)-(PPH3)(2)-RU]=C=C(PH)-CH2COOME]-[PF6]
SpectraBase Compound ID 8762VSa3UPB
InChI InChI=1S/2C18H15P.C11H10O2.C5H.F6P.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(8-11(12)13-2)10-6-4-3-5-7-10;1-2-4-5-3-1;1-7(2,3,4,5)6;/h2*1-15H;3-7H,8H2,2H3;1H;;/q;;;;2*-1/p+2
InChIKey IUKFEUJRXCCZOD-UHFFFAOYSA-P
Mol Weight 1007.9 g/mol
Molecular Formula C52H43F6O2P3Ru
Exact Mass 1008.142351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IW0jOCcwjvx
Name [[(ETA(5)-C5H5)-(PPH3)(2)-RU]=C=C(PH)-CH2COOME]-[PF6]
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H41F6O2P3Ru
InChI InChI=1S/2C18H15P.C11H10O2.C5H.F6P.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(8-11(12)13-2)10-6-4-3-5-7-10;1-2-4-5-3-1;1-7(2,3,4,5)6;/h2*1-15H;3-7H,8H2,2H3;1H;;/q;;;;2*-1/p+2
InChIKey IUKFEUJRXCCZOD-UHFFFAOYSA-P
Literature Reference Author P.C.TING,Y.C.LIN,G.H.LEE,M.C.CHENG,Y.WANG
Literature Reference Citation J.AM.CHEM.SOC.,118,6433(1996)
Literature Reference DOI 10.1021/ja960001k
Molecular Weight 1005.878 g/mol
Sample ID 36733
Solvent CDCl3