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6,19-DIOCTYL-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 ENvatKGAgEk
InChI InChI=1S/C34H66N10/c1-3-5-7-9-11-13-19-43-21-15-35-27-31-25-33(41-39-31)29-37-17-23-44(20-14-12-10-8-6-4-2)24-18-38-30-34-26-32(40-42-34)28-36-16-22-43/h25-26,35-38H,3-24,27-30H2,1-2H3,(H,39,41)(H,40,42)
InChIKey QYZIRYJVBKAYJE-UHFFFAOYSA-N
Mol Weight 615.0 g/mol
Molecular Formula C34H66N10
Exact Mass 614.547192 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3UGi0LgrPe
Name 6,19-DIOCTYL-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 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H66N10
InChI InChI=1S/C34H66N10/c1-3-5-7-9-11-13-19-43-21-15-35-27-31-25-33(41-39-31)29-37-17-23-44(20-14-12-10-8-6-4-2)24-18-38-30-34-26-32(40-42-34)28-36-16-22-43/h25-26,35-38H,3-24,27-30H2,1-2H3,(H,39,41)(H,40,42)
InChIKey QYZIRYJVBKAYJE-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 614.965 g/mol
Solvent CDCl3
Source File Reference UWLU36619