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1,5-Bis(dimethylamidomethyl)-9-(4-tolyl-sulfonyl )-1,5,9-triaza-cyclododecane

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1,5-Bis(dimethylamidomethyl)-9-(4-tolyl-sulfonyl )-1,5,9-triaza-cyclododecane
SpectraBase Compound ID 5SdPmdvcWGm
InChI InChI=1S/C24H41N5O4S/c1-21-9-11-22(12-10-21)34(32,33)29-17-7-15-27(19-23(30)25(2)3)13-6-14-28(16-8-18-29)20-24(31)26(4)5/h9-12H,6-8,13-20H2,1-5H3
InChIKey FKVJUGWAJJHWBN-UHFFFAOYSA-N
Mol Weight 495.7 g/mol
Molecular Formula C24H41N5O4S
Exact Mass 495.287926 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7HHyudoZDO
Name 1,5-Bis(dimethylamidomethyl)-9-(4-tolyl-sulfonyl )-1,5,9-triaza-cyclododecane
CAS Registry Number 127603-38-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H41N5O4S
InChI InChI=1S/C24H41N5O4S/c1-21-9-11-22(12-10-21)34(32,33)29-17-7-15-27(19-23(30)25(2)3)13-6-14-28(16-8-18-29)20-24(31)26(4)5/h9-12H,6-8,13-20H2,1-5H3
InChIKey FKVJUGWAJJHWBN-UHFFFAOYSA-N
Instrument Name Bruker AC-250
Literature Reference I.M. Helps, D. Parker, K.J. Jankowski, J. Chem. Soc. Perkin I 2079 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3