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N,N,N',N',2-PENTAMETHYL-3-PHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
SpectraBase Compound ID FZEQj0S1GkZ
InChI InChI=1S/C24H20B.C15H22N3O/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;1-16(2)15(17(3)4)13-11-19-18(5)14(13)12-9-7-6-8-10-12/h1-20H;6-11,14H,1-5H3/q-1;+1
InChIKey TWPORNQUGKABGO-UHFFFAOYSA-N
Mol Weight 579.6 g/mol
Molecular Formula C39H42BN3O
Exact Mass 579.342093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xOVUB9LWta
Name N,N,N',N',2-PENTAMETHYL-3-PHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H42BN3O
InChI InChI=1S/C24H20B.C15H22N3O/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;1-16(2)15(17(3)4)13-11-19-18(5)14(13)12-9-7-6-8-10-12/h1-20H;6-11,14H,1-5H3/q-1;+1
InChIKey TWPORNQUGKABGO-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 579.592 g/mol
Solvent CD3CN
Source File Reference UWLU83595