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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 7PJIyNP00U3
InChI InChI=1S/C18H34N10/c1-5-21-11-15-9-16(26-25-15)13-23-7-3-20-4-8-24-14-18-10-17(27-28-18)12-22-6-2-19-1/h9-10,19-24H,1-8,11-14H2,(H,25,26)(H,27,28)
InChIKey ZKRCPULUZCZXAY-UHFFFAOYSA-N
Mol Weight 390.5 g/mol
Molecular Formula C18H34N10
Exact Mass 390.296791 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6geDI4EVaK
Name 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 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H34N10
InChI InChI=1S/C18H34N10/c1-5-21-11-15-9-16(26-25-15)13-23-7-3-20-4-8-24-14-18-10-17(27-28-18)12-22-6-2-19-1/h9-10,19-24H,1-8,11-14H2,(H,25,26)(H,27,28)
InChIKey ZKRCPULUZCZXAY-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 390.535 g/mol
Sample ID 59268
Solvent D2O;PH=4.8