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

View entire compound with spectra: 2 NMR

[NI-BR-[ORTHO-C6H4-B(PIN)]-(DPPB)]
SpectraBase Compound ID KeP2UV8FPhg
InChI InChI=1S/C28H28P2.C12H16BO2.BrH.Ni/c1-5-15-25(16-6-1)29(26-17-7-2-8-18-26)23-13-14-24-30(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-11(2)12(3,4)15-13(14-11)10-8-6-5-7-9-10;;/h1-12,15-22H,13-14,23-24H2;5-8H,1-4H3;1H;/q;;;-1/p+1
InChIKey VQTPTMFUEZIMQF-UHFFFAOYSA-O
Mol Weight 770.2 g/mol
Molecular Formula C40H46BBrNiO2P2
Exact Mass 768.16029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMtlxvRC7qf
Name [NI-BR-[ORTHO-C6H4-B(PIN)]-(DPPB)]
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H44BBrNiO2P2
InChI InChI=1S/C28H28P2.C12H16BO2.BrH.Ni/c1-5-15-25(16-6-1)29(26-17-7-2-8-18-26)23-13-14-24-30(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-11(2)12(3,4)15-13(14-11)10-8-6-5-7-9-10;;/h1-12,15-22H,13-14,23-24H2;5-8H,1-4H3;1H;/q;;;-1/p+1
InChIKey VQTPTMFUEZIMQF-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 768.140 g/mol
Sample ID 34031
Solvent CD2Cl2