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N,N,N',N'-TETRAMETHYL-1-[3-(PHTHALIMIDO)-PROPYL]-1,2,3-TRIAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
SpectraBase Compound ID 4LpDQMpgB5L
InChI InChI=1S/C24H20B.C18H23N6O2/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;1-21(2)16(22(3)4)15-12-23(20-19-15)10-7-11-24-17(25)13-8-5-6-9-14(13)18(24)26/h1-20H;5-6,8-9,12H,7,10-11H2,1-4H3/q-1;+1
InChIKey ZMLQNVPPDZEVMT-UHFFFAOYSA-N
Mol Weight 674.66 g/mol
Molecular Formula C42H43BN6O2
Exact Mass 674.354055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 20dGDBrWkI9
Name N,N,N',N'-TETRAMETHYL-1-[3-(PHTHALIMIDO)-PROPYL]-1,2,3-TRIAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H43BN6O2
InChI InChI=1S/C24H20B.C18H23N6O2/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;1-21(2)16(22(3)4)15-12-23(20-19-15)10-7-11-24-17(25)13-8-5-6-9-14(13)18(24)26/h1-20H;5-6,8-9,12H,7,10-11H2,1-4H3/q-1;+1
InChIKey ZMLQNVPPDZEVMT-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 674.652 g/mol
Solvent DMSO-D6
Source File Reference UWLU83601