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6,19-DIBENZYL-3,6,9,12,13,16,19,22,25,26-DECAAZATRICYCLO-[22.1.1(11,14)]-OCTACOSA-1(27),11,14(28),24-TETRAENE
SpectraBase Compound ID KepfOnhJEHa
InChI InChI=1S/C32H46N10/c1-3-7-27(8-4-1)25-41-15-11-33-21-29-19-31(39-37-29)23-35-13-17-42(26-28-9-5-2-6-10-28)18-14-36-24-32-20-30(38-40-32)22-34-12-16-41/h1-10,19-20,33-36H,11-18,21-26H2,(H,37,39)(H,38,40)
InChIKey FQYGMVKWAKJLHF-UHFFFAOYSA-N
Mol Weight 570.8 g/mol
Molecular Formula C32H46N10
Exact Mass 570.390692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D2vFgrWVDhx
Name 6,19-DIBENZYL-3,6,9,12,13,16,19,22,25,26-DECAAZATRICYCLO-[22.1.1(11,14)]-OCTACOSA-1(27),11,14(28),24-TETRAENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H46N10
InChI InChI=1S/C32H46N10/c1-3-7-27(8-4-1)25-41-15-11-33-21-29-19-31(39-37-29)23-35-13-17-42(26-28-9-5-2-6-10-28)18-14-36-24-32-20-30(38-40-32)22-34-12-16-41/h1-10,19-20,33-36H,11-18,21-26H2,(H,37,39)(H,38,40)
InChIKey FQYGMVKWAKJLHF-UHFFFAOYSA-N
Literature Reference Author C.MIRANDA,F.ESCARTI,L.LAMARQUE,M.J.R.YUNTA,P.NAVARRO,E.GARCI A-ESPANA,M.L.JIMENO
Literature Reference Citation J.AM.CHEM.SOC.,126,823(2004)
Literature Reference DOI 10.1021/ja035671m
Molecular Weight 570.784 g/mol
Solvent CDCl3
Source File Reference UWLU36617