John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4fBxQ8t4m9f SpectraBase Spectrum ID=2UYoRc81SOl

(accessed ).
CP*FE-(DPPE)-BR
SpectraBase Compound ID 4fBxQ8t4m9f
InChI InChI=1S/C26H24P2.C10H15.BrH.Fe/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-6-7(2)9(4)10(5)8(6)3;;/h1-20H,21-22H2;1-5H3;1H;/q;;;-1/p+1
InChIKey UFQDLMOYYSVCJV-UHFFFAOYSA-O
Mol Weight 669.4 g/mol
Molecular Formula C36H39BrFeP2
Exact Mass 668.105979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UYoRc81SOl
Name CP*FE-(DPPE)-BR
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H39BrFeP2
InChI InChI=1S/C26H24P2.C10H15.BrH.Fe/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-6-7(2)9(4)10(5)8(6)3;;/h1-20H,21-22H2;1-5H3;1H;/q;;;-1/p+1
InChIKey UFQDLMOYYSVCJV-UHFFFAOYSA-O
Literature Reference Author M.TILSET,I.FJELDAHL,J.R.HAMON,P.HAMON,L.TOUPET,J.Y.SAILLARD, K.COSTUAS,A.HAYNES
Literature Reference Citation J.AM.CHEM.SOC.,123,9984(2001)
Literature Reference DOI 10.1021/ja0106927
Molecular Weight 669.404 g/mol
Solvent C6D6
Source File Reference UWVN29875
SpectraBase Batch ID I6l3cGghzsw