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[1,4,5,6-ETA-(4)-(2-HYDROXYCYClOOCTA-4-ENE-1,6-DI-YL)]-[K-(3)-FAK-N,N-DI-(2-PYRIDYLMETHYL)-AMINE]-RHODIUM-(III)-TETRAPHENYLBORATE
SpectraBase Compound ID AA7ulTX94dZ
InChI InChI=1S/C24H20B.C12H12N3.C8H13O.Rh/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-7-14-11(5-1)9-13-10-12-6-2-4-8-15-12;9-8-6-4-2-1-3-5-7-8;/h1-20H;1-8H,9-10H2;1-2,4,8-9H,3,5-7H2;/q2*-1;;+2
InChIKey CJQBGLWLPYNQPX-UHFFFAOYSA-N
Mol Weight 745.58 g/mol
Molecular Formula C44H45BN3ORh
Exact Mass 745.271058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtqtE27jFn5
Name [1,4,5,6-ETA-(4)-(2-HYDROXYCYClOOCTA-4-ENE-1,6-DI-YL)]-[K-(3)-FAK-N,N-DI-(2-PYRIDYLMETHYL)-AMINE]-RHODIUM-(III)-TETRAPHENYLBORATE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H45BN3ORh
InChI InChI=1S/C24H20B.C12H12N3.C8H13O.Rh/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-7-14-11(5-1)9-13-10-12-6-2-4-8-15-12;9-8-6-4-2-1-3-5-7-8;/h1-20H;1-8H,9-10H2;1-2,4,8-9H,3,5-7H2;/q2*-1;;+2
InChIKey CJQBGLWLPYNQPX-UHFFFAOYSA-N
Literature Reference Author B.D.BRUIN,J.A.BRANDS,J.J.J.M.DONNERS,M.P.J.DONNERS,R.D.GELDE R,J.M.M.SMITS,A.W.GA
Literature Reference Citation CHEM.EUR.J.,5,2921(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19991001)5:10<2921::aid-chem2921>3.0.co;2-1
Molecular Weight 745.576 g/mol
Solvent ACETONE-D6
Source File Reference UWVN4271