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(2R,5S,2'S)-2-[2'-(FERROCENYLIDENEAMINO)-3',3'-DIMETHYLBUTOXY]-3-PHENYL-1,3-DIAZA-2-PHOSPHABICYCLO-[3.3.0]-OCTANE
SpectraBase Compound ID 2G4MqWJCZ99
InChI InChI=1S/C23H27N3OP.C5H.Fe/c1-23(2,3)22(24-16-19-10-7-8-11-19)18-27-28-25-15-9-14-21(25)17-26(28)20-12-5-4-6-13-20;1-2-4-5-3-1;/h4-6,12-13,16,21-22H,9,14-15,17-18H2,1-3H3;1H;/b24-16+;;/t21-,22+,28?;;/m0../s1
InChIKey QEMRJJBFWNKGCO-VFSPQXBTSA-N
Mol Weight 509.37 g/mol
Molecular Formula C28H28FeN3OP
Exact Mass 509.131936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID uJmqUqZcv6
Name (2R,5S,2'S)-2-[2'-(FERROCENYLIDENEAMINO)-3',3'-DIMETHYLBUTOXY]-3-PHENYL-1,3-DIAZA-2-PHOSPHABICYCLO-[3.3.0]-OCTANE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28FeN3OP
InChI InChI=1S/C23H27N3OP.C5H.Fe/c1-23(2,3)22(24-16-19-10-7-8-11-19)18-27-28-25-15-9-14-21(25)17-26(28)20-12-5-4-6-13-20;1-2-4-5-3-1;/h4-6,12-13,16,21-22H,9,14-15,17-18H2,1-3H3;1H;/b24-16+;;/t21-,22+,28?;;/m0../s1
InChIKey QEMRJJBFWNKGCO-VFSPQXBTSA-N
Literature Reference Author V.N.TSAREV,S.E.LYUBIMOV,O.G.BONDAREV,A.A.KORLYUKOV,M.Y.ANTIP IN,P.V.PETROVSKII,V.
Literature Reference Citation EUR.J.ORG.CHEM.,2097(2005)
Molecular Weight 509.371 g/mol
Sample ID 39471
Solvent CDCl3