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1,10-Diacetyl-5,21-dimethyl-8,24-pentamethylenedioxy-1,10,17,26-tetraaza(2.2)(mo)2-cyclophane

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1,10-Diacetyl-5,21-dimethyl-8,24-pentamethylenedioxy-1,10,17,26-tetraaza(2.2)(mo)2-cyclophane
SpectraBase Compound ID AUQnxLya8oE
InChI InChI=1S/C39H44N4O4/c1-26-18-30-22-40-34-12-6-8-14-36(34)42(28(3)44)24-32-20-27(2)21-33-25-43(29(4)45)37-15-9-7-13-35(37)41-23-31(19-26)38(30)46-16-10-5-11-17-47-39(32)33/h6-9,12-15,18-21,40-41H,5,10-11,16-17,22-25H2,1-4H3
InChIKey PAPUYTRLNUTDHS-UHFFFAOYSA-N
Mol Weight 632.8 g/mol
Molecular Formula C39H44N4O4
Exact Mass 632.336256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5FLa8as6k7i
Name 1,10-Diacetyl-5,21-dimethyl-8,24-pentamethylenedioxy-1,10,17,26-tetraaza(2.2)(mo)2-cyclophane
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C39H44N4O4
InChI InChI=1S/C39H44N4O4/c1-26-18-30-22-40-34-12-6-8-14-36(34)42(28(3)44)24-32-20-27(2)21-33-25-43(29(4)45)37-15-9-7-13-35(37)41-23-31(19-26)38(30)46-16-10-5-11-17-47-39(32)33/h6-9,12-15,18-21,40-41H,5,10-11,16-17,22-25H2,1-4H3
InChIKey PAPUYTRLNUTDHS-UHFFFAOYSA-N
Literature Reference M. Frederickson, N.A. Bailey, E. Haslam, J. Chem. Soc. Perkin I 2353 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported