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TRANS-(DIPPE)-NI-(ETA-(2)-C=C-CROTONONITRILE-BPH3)

View entire compound with spectra: 4 NMR

TRANS-(DIPPE)-NI-(ETA-(2)-C=C-CROTONONITRILE-BPH3)
SpectraBase Compound ID BryMuH6tchg
InChI InChI=1S/C22H18BN.C14H32P2.Ni/c1-2-3-19-24-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;1-11(2)15(12(3)4)9-10-16(13(5)6)14(7)8;/h4-18H,1H3;11-14H,9-10H2,1-8H3;/q;;-2/p+2
InChIKey DPAUYEWGXBUPEG-UHFFFAOYSA-P
Mol Weight 630.3 g/mol
Molecular Formula C36H52BNNiP2
Exact Mass 629.302147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38AyyNod7dS
Name CIS-(DIPPE)-NI-(ETA-(2)-C=C-CROTONONITRILE-BPH3)
Compound Number TRANS-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H50BNNiP2
InChI InChI=1S/C22H18BN.C14H32P2.Ni/c1-2-3-19-24-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;1-11(2)15(12(3)4)9-10-16(13(5)6)14(7)8;/h4-18H,1H3;11-14H,9-10H2,1-8H3;/q;;-2/p+2
InChIKey DPAUYEWGXBUPEG-UHFFFAOYSA-P
Literature Reference Author N.M.BRUNKAN,D.M.BRESTENSKY,W.D.JONES
Literature Reference Citation J.AM.CHEM.SOC.,126,3627(2004)
Literature Reference DOI 10.1021/ja037002e
Molecular Weight 628.247 g/mol
Solvent THF-D8
Source File Reference UWMZ24114