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IJRMCYXUWSHQMH-UHFFFAOYSA-Q

View entire compound with spectra: 2 NMR

IJRMCYXUWSHQMH-UHFFFAOYSA-Q
SpectraBase Compound ID 2vzpXZomWX0
InChI InChI=1S/2C25H22P2.C17H14.ClH.F6P.Ru/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-4-17(15-9-5-13(2)6-10-15)16-11-7-14(3)8-12-16;;1-7(2,3,4,5)6;/h2*1-20H,21H2;5-12H,2-3H3;1H;;/q;;;;-1;-2/p+3
InChIKey IJRMCYXUWSHQMH-UHFFFAOYSA-Q
Mol Weight 1272.6 g/mol
Molecular Formula C67H62ClF6P5Ru
Exact Mass 1272.217574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4NqcfTdEXmZ
Name IJRMCYXUWSHQMH-UHFFFAOYSA-Q
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C67H58ClF6P5Ru
InChI InChI=1S/2C25H22P2.C17H14.ClH.F6P.Ru/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-4-17(15-9-5-13(2)6-10-15)16-11-7-14(3)8-12-16;;1-7(2,3,4,5)6;/h2*1-20H,21H2;5-12H,2-3H3;1H;;/q;;;;-1;-2/p+3
InChIKey IJRMCYXUWSHQMH-UHFFFAOYSA-Q
Literature Reference Author C.Y.WONG,C.M.CHE,M.C.W.CHAN,K.H.LEUNG,D.L.PHILLIPS,N.ZHU
Literature Reference Citation J.AM.CHEM.SOC.,126,2501(2004)
Literature Reference DOI 10.1021/ja0380648
Molecular Weight 1268.580 g/mol
Solvent ACETONE-D6
Source File Reference UWVN31858