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12-Hexadecyl-7,17,22,27-tetraoxa-1,4,10,14-tetraaza-tricyclo(12.5.5.5/4,10/)nonacosane potassium complex cation

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12-Hexadecyl-7,17,22,27-tetraoxa-1,4,10,14-tetraaza-tricyclo(12.5.5.5/4,10/)nonacosane potassium complex cation
SpectraBase Compound ID G04a9CA6O6l
InChI InChI=1S/C37H74N4O4.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-37-35-40-23-31-42-27-19-38(20-28-43-32-24-40)17-18-39-21-29-44-33-25-41(36-37)26-34-45-30-22-39;/h37H,2-36H2,1H3;/q;+1
InChIKey MVMCICRRANIGKN-UHFFFAOYSA-N
Mol Weight 682.2 g/mol
Molecular Formula C37H78KN4O4
Exact Mass 681.566013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7hUIYfmBHAq
Name 12-Hexadecyl-7,17,22,27-tetraoxa-1,4,10,14-tetraaza-tricyclo(12.5.5.5/4,10/)nonacosane potassium complex cation
Comments HEXAFLUOROPHOSPHATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C37H78KN4O4
InChI InChI=1S/C37H74N4O4.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-37-35-40-23-31-42-27-19-38(20-28-43-32-24-40)17-18-39-21-29-44-33-25-41(36-37)26-34-45-30-22-39;/h37H,2-36H2,1H3;/q;+1
InChIKey MVMCICRRANIGKN-UHFFFAOYSA-N
Instrument Name Varian XL-300
Literature Reference P.L. Anelli, T. Beringhelli, H. Molinari, Magn. Res. Chem. 25, 417 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3