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9,10,12,13,15,16-Hexahydro-3,7:18,22-dimetheno-8,11,14,17,1,24-benzotetraoxadiaza-cyclohexacosine-29,23-diol-/per-O/bari
SpectraBase Compound ID Fx3ZGdj6vkN
InChI InChI=1S/C26H26N2O6.Ba/c29-25-19-5-3-9-23(25)33-15-13-31-11-12-32-14-16-34-24-10-4-6-20(26(24)30)18-28-22-8-2-1-7-21(22)27-17-19;/h1-10,17-18,29-30H,11-16H2;/q;+2/b27-17+,28-18+;
InChIKey HILDOAFOMRJAJW-GHCZSDNOSA-N
Mol Weight 599.83 g/mol
Molecular Formula C26H26BaN2O6
Exact Mass 600.084334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7KJweh4DgOe
Name 9,10,12,13,15,16-Hexahydro-3,7:18,22-dimetheno-8,11,14,17,1,24-benzotetraoxadiaza-cyclohexacosine-29,23-diol-/per-O/bari
Comments DIPERCHLORATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H26BaN2O6
InChI InChI=1S/C26H26N2O6.Ba/c29-25-19-5-3-9-23(25)33-15-13-31-11-12-32-14-16-34-24-10-4-6-20(26(24)30)18-28-22-8-2-1-7-21(22)27-17-19;/h1-10,17-18,29-30H,11-16H2;/q;+2/b27-17+,28-18+;
InChIKey HILDOAFOMRJAJW-GHCZSDNOSA-N
Instrument Name SF = 200 MHz
Literature Reference C.J. Van Staveren, J. Van Eerden, J. Am. Chem. Soc. 110, 4994 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6