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13,26-DIBENZYL-3,6,9,12,13,16,19,22,25,26-DECAAZATRICYCLO-[22.2.1.1(11,14)]-OCTACOSA-1(27),11,14(28),24-TETRAENE
SpectraBase Compound ID 2tPQCLJKcsM
InChI InChI=1S/C32H46N10/c1-3-7-27(8-4-1)25-41-31-19-29(39-41)21-35-15-11-34-14-18-38-24-32-20-30(22-36-16-12-33-13-17-37-23-31)40-42(32)26-28-9-5-2-6-10-28/h1-10,19-20,33-38H,11-18,21-26H2
InChIKey CSXJEYXZBSEEOY-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 Arn7yIE4xiA
Name 13,26-DIBENZYL-3,6,9,12,13,16,19,22,25,26-DECAAZATRICYCLO-[22.2.1.1(11,14)]-OCTACOSA-1(27),11,14(28),24-TETRAENE
Compound Number 6B
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)25-41-31-19-29(39-41)21-35-15-11-34-14-18-38-24-32-20-30(22-36-16-12-33-13-17-37-23-31)40-42(32)26-28-9-5-2-6-10-28/h1-10,19-20,33-38H,11-18,21-26H2
InChIKey CSXJEYXZBSEEOY-UHFFFAOYSA-N
Literature Reference Author V.J.ARAN,M.KUMAR,J.MOLINA,L.LAMARQUE,P.NAVARRO,E.GARCIA-ESPA NA,J.A.RAMIREZ,S.V.L
Literature Reference Citation J.ORG.CHEM.,64,6135(1999)
Literature Reference DOI 10.1021/jo981699i
Molecular Weight 570.784 g/mol
Sample ID 59273
Solvent D2O;PH=4.5