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8,9:16,17-Dibenzo-10,15-bistosyl-12,13-didehydro-10,15-diaza-17-crown-5
SpectraBase Compound ID 7R1GTU3xHUp
InChI InChI=1S/C34H36N2O7S2/c1-27-13-17-29(18-14-27)44(37,38)35-21-7-8-22-36(45(39,40)30-19-15-28(2)16-20-30)32-10-4-6-12-34(32)43-26-24-41-23-25-42-33-11-5-3-9-31(33)35/h3-20H,21-26H2,1-2H3/b8-7-
InChIKey AYSINWPATGBYRS-FPLPWBNLSA-N
Mol Weight 648.8 g/mol
Molecular Formula C34H36N2O7S2
Exact Mass 648.196394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B15XioUafg
Name 8,9:16,17-Dibenzo-10,15-bistosyl-12,13-didehydro-10,15-diaza-17-crown-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C34H36N2O7S2
InChI InChI=1S/C34H36N2O7S2/c1-27-13-17-29(18-14-27)44(37,38)35-21-7-8-22-36(45(39,40)30-19-15-28(2)16-20-30)32-10-4-6-12-34(32)43-26-24-41-23-25-42-33-11-5-3-9-31(33)35/h3-20H,21-26H2,1-2H3/b8-7-
InChIKey AYSINWPATGBYRS-FPLPWBNLSA-N
Instrument Name Bruker WP-200
Literature Reference E. Kleinpeter, M. Gaebler, W. Schroth, Magn. Res. Chem. 26, 380 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2