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N,N,N',N',2-PENTAMETHYL-3,5-DIPHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
SpectraBase Compound ID 8ci3QJqHnhd
InChI InChI=1S/C24H20B.C21H26N3O/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;1-22(2)21(23(3)4)18-19(16-12-8-6-9-13-16)24(5)25-20(18)17-14-10-7-11-15-17/h1-20H;6-15,19H,1-5H3/q-1;+1
InChIKey QPTHPTDUYHAMAC-UHFFFAOYSA-N
Mol Weight 655.69 g/mol
Molecular Formula C45H46BN3O
Exact Mass 655.373393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqyKTbu4JQy
Name N,N,N',N',2-PENTAMETHYL-3,5-DIPHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H46BN3O
InChI InChI=1S/C24H20B.C21H26N3O/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;1-22(2)21(23(3)4)18-19(16-12-8-6-9-13-16)24(5)25-20(18)17-14-10-7-11-15-17/h1-20H;6-15,19H,1-5H3/q-1;+1
InChIKey QPTHPTDUYHAMAC-UHFFFAOYSA-N
Literature Reference Author W.WEINGAERTNER,G.MAAS
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6372(2012)
Literature Reference DOI 10.1002/ejoc.201201005
Molecular Weight 655.690 g/mol
Solvent CD3CN
Source File Reference UWLU83597