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Tetrabutylphosphonium-tetraphenylborate

View entire compound with spectra: 2 NMR

Tetrabutylphosphonium-tetraphenylborate
SpectraBase Compound ID DNoPLdnlXkq
InChI InChI=1S/C24H20B.C16H36P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h1-20H;5-16H2,1-4H3/q-1;+1
InChIKey OGWSZNMGVXKACZ-UHFFFAOYSA-N
Mol Weight 578.7 g/mol
Molecular Formula C40H56BP
Exact Mass 578.421269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BVqNw96QprM
Name Tetrabutylphosphonium-tetraphenylborate
Comments Computed using HOSE algorithm
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Exact Mass 578.421268971 u
Formula C40H56BP
InChI InChI=1S/C24H20B.C16H36P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h1-20H;5-16H2,1-4H3/q-1;+1
InChIKey OGWSZNMGVXKACZ-UHFFFAOYSA-N
Molecular Weight 578.672 g/mol
SMILES C=1([B-](C=2C=CC=CC2)(C=2C=CC=CC2)C=2C=CC=CC2)C=CC=CC1.C([P+](CCCC)(CCCC)CCCC)CCC