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5-CYCLOPROPYL-N,N,N',N'-TETRAMETHYL-1-[3-(PHTHALIMIDO)-PROPYL]-1,2,3-TRIAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
SpectraBase Compound ID CNX8hZEgl1o
InChI InChI=1S/C24H20B.C21H27N6O2/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;1-24(2)19(25(3)4)17-18(14-10-11-14)27(23-22-17)13-7-12-26-20(28)15-8-5-6-9-16(15)21(26)29/h1-20H;5-6,8-9,14H,7,10-13H2,1-4H3/q-1;+1
InChIKey PTIIYMJSUMRZLX-UHFFFAOYSA-N
Mol Weight 714.72 g/mol
Molecular Formula C45H47BN6O2
Exact Mass 714.385355 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3EnPJj8Cmb8
Name 5-CYCLOPROPYL-N,N,N',N'-TETRAMETHYL-1-[3-(PHTHALIMIDO)-PROPYL]-1,2,3-TRIAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H47BN6O2
InChI InChI=1S/C24H20B.C21H27N6O2/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;1-24(2)19(25(3)4)17-18(14-10-11-14)27(23-22-17)13-7-12-26-20(28)15-8-5-6-9-16(15)21(26)29/h1-20H;5-6,8-9,14H,7,10-13H2,1-4H3/q-1;+1
InChIKey PTIIYMJSUMRZLX-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 714.717 g/mol
Solvent CD3CN
Source File Reference UWLU83602