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1,12-Bis(4-tosyl)-tetraaza-bicyclo((10.2.2)hexadecane
SpectraBase Compound ID 9OJLfAmxDDV
InChI InChI=1S/C26H38N4O4S2/c1-23-5-9-25(10-6-23)35(31,32)29-15-3-13-27-17-19-28(20-18-27)14-4-16-30(22-21-29)36(33,34)26-11-7-24(2)8-12-26/h5-12H,3-4,13-22H2,1-2H3
InChIKey MQMMNBLSFPQSTC-UHFFFAOYSA-N
Mol Weight 534.7 g/mol
Molecular Formula C26H38N4O4S2
Exact Mass 534.233448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3GTHsuhf9U
Name 1,12-Bis(4-tosyl)-tetraaza-bicyclo((10.2.2)hexadecane
CAS Registry Number 78707-09-2
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H38N4O4S2
InChI InChI=1S/C26H38N4O4S2/c1-23-5-9-25(10-6-23)35(31,32)29-15-3-13-27-17-19-28(20-18-27)14-4-16-30(22-21-29)36(33,34)26-11-7-24(2)8-12-26/h5-12H,3-4,13-22H2,1-2H3
InChIKey MQMMNBLSFPQSTC-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference H. Yamamoto, K. Maruoka, J. Am. Chem. Soc. 103, 4186 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3