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[NI-BR-[ORTHO-C6H4-B(PIN)]-(DPPE)]

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[NI-BR-[ORTHO-C6H4-B(PIN)]-(DPPE)]
SpectraBase Compound ID 2EbAhNow3bT
InChI InChI=1S/C26H24P2.C12H16BO2.BrH.Ni/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;1-11(2)12(3,4)15-13(14-11)10-8-6-5-7-9-10;;/h1-20H,21-22H2;5-8H,1-4H3;1H;/q;;;-1/p+1
InChIKey PESCNOBENPKXNJ-UHFFFAOYSA-O
Mol Weight 742.1 g/mol
Molecular Formula C38H42BBrNiO2P2
Exact Mass 740.12899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BOOf5HoMMR
Name [NI-BR-[ORTHO-C6H4-B(PIN)]-(DPPE)]
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40BBrNiO2P2
InChI InChI=1S/C26H24P2.C12H16BO2.BrH.Ni/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;1-11(2)12(3,4)15-13(14-11)10-8-6-5-7-9-10;;/h1-20H,21-22H2;5-8H,1-4H3;1H;/q;;;-1/p+1
InChIKey PESCNOBENPKXNJ-UHFFFAOYSA-O
Literature Reference Author M.RETBOLL,A.J.EDWARDS,A.D.RAE,A.C.WILLIS,M.A.BENNETT,E.WENGE R
Literature Reference Citation J.AM.CHEM.SOC.,124,8348(2002)
Literature Reference DOI 10.1021/ja0264091
Molecular Weight 740.086 g/mol
Sample ID 34030
Solvent CD2Cl2