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4,8,12-TRI-N-HEXYL-4,8,12-TRIAZATRIANGULENIUM-TETRAFLUOROBORATE

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4,8,12-TRI-N-HEXYL-4,8,12-TRIAZATRIANGULENIUM-TETRAFLUOROBORATE
SpectraBase Compound ID LHu6Nk2nuRP
InChI InChI=1S/C37H49N3.BF4/c1-4-7-10-13-25-38-28-19-16-21-30-34(28)37-35-29(38)20-17-22-31(35)40(27-15-12-9-6-3)33-24-18-23-32(36(33)37)39(30)26-14-11-8-5-2;2-1(3,4)5/h16-24,37H,4-15,25-27H2,1-3H3;/q;-1
InChIKey YRRJWVRQVSGJQD-UHFFFAOYSA-N
Mol Weight 622.6 g/mol
Molecular Formula C37H49BF4N3
Exact Mass 622.395566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8AcJz9ASVl
Name 4,8,12-TRI-N-HEXYL-4,8,12-TRIAZATRIANGULENIUM-TETRAFLUOROBORATE
Compound Number 2C-[BF4]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H49BF4N3
InChI InChI=1S/C37H49N3.BF4/c1-4-7-10-13-25-38-28-19-16-21-30-34(28)37-35-29(38)20-17-22-31(35)40(27-15-12-9-6-3)33-24-18-23-32(36(33)37)39(30)26-14-11-8-5-2;2-1(3,4)5/h16-24,37H,4-15,25-27H2,1-3H3;/q;-1
InChIKey YRRJWVRQVSGJQD-UHFFFAOYSA-N
Literature Reference Author C.NICOLAS,J.LACOUR
Literature Reference Citation ORG.LETTERS,8,4343(2006)
Literature Reference DOI 10.1021/ol0617392
Molecular Weight 622.620 g/mol
Sample ID 60212
Solvent CD3CN