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Hexadecahydro-3,7:27,31-dimetheno-8,11,14,17,20,23,26,1,33-benzoheptaoxa-diaza-cyclodopentatriacontine-38,39-diol

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Hexadecahydro-3,7:27,31-dimetheno-8,11,14,17,20,23,26,1,33-benzoheptaoxa-diaza-cyclodopentatriacontine-38,39-diol
SpectraBase Compound ID EbsTtVl6Pkm
InChI InChI=1S/C32H42N2O9/c35-31-25-5-3-9-29(31)42-21-19-40-17-15-38-13-11-37-12-14-39-16-18-41-20-22-43-30-10-4-6-26(32(30)36)24-34-28-8-2-1-7-27(28)33-23-25/h1-10,33-36H,11-24H2
InChIKey ATBJPZVNOMVJDP-UHFFFAOYSA-N
Mol Weight 598.7 g/mol
Molecular Formula C32H42N2O9
Exact Mass 598.289031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96jNNRMg2fo
Name Hexadecahydro-3,7:27,31-dimetheno-8,11,14,17,20,23,26,1,33-benzoheptaoxa-diaza-cyclodopentatriacontine-38,39-diol
Comments 1,2,9,10,12,13,15,16,48,19,21,22,24,25,32,33-HEXADECAHYDRO
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H42N2O9
InChI InChI=1S/C32H42N2O9/c35-31-25-5-3-9-29(31)42-21-19-40-17-15-38-13-11-37-12-14-39-16-18-41-20-22-43-30-10-4-6-26(32(30)36)24-34-28-8-2-1-7-27(28)33-23-25/h1-10,33-36H,11-24H2
InChIKey ATBJPZVNOMVJDP-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference C. Van Staveren, V. Aarts, P. Grootenhuis, J. Am. Chem. Soc. 110, 8134 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3