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Nickel, 1,5-cyclooctadienepentaphenylborole

View entire compound with spectra: 1 MS (GC)

Nickel, 1,5-cyclooctadienepentaphenylborole
SpectraBase Compound ID QmoMsMMI6J
InChI InChI=1S/C34H25B.C8H12.Ni/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;1-2-4-6-8-7-5-3-1;/h1-25H;1-2,7-8H,3-6H2;/b;2-1-,8-7-;
InChIKey DQZXNFXTQUOHFL-GHDUESPLSA-N
Mol Weight 607.23 g/mol
Molecular Formula C42H33BNi
Exact Mass 606.202873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ol4hCx0HhU
Name Nickel, 1,5-cyclooctadienepentaphenylborole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H37BNi
InChI InChI=1S/C34H25B.C8H12.Ni/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;1-2-4-6-8-7-5-3-1;/h1-25H;1-2,7-8H,3-6H2;/b;2-1-,8-7-;
InChIKey DQZXNFXTQUOHFL-GHDUESPLSA-N
Molecular Weight 607.229 g/mol
SMILES [Ni].c1ccc(B2[C]([C]([C]([C]2c2ccccc2)c2ccccc2)c2ccccc2)c2ccccc2)cc1.C1C[C][C]CC[C][C]1
SPLASH splash10-0udi-1634093000-64643c8b94f9838dc40e
Source of Spectrum HE-1986-67-0
Wiley ID 1410956