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(1RS,13SR,14RS)-1-OCTYL-4,7,10-TRIAZA-1-AZONIATETRACYCLO-[5.5.2.0.(4,14)0.(10,13)]-TETRADECANE-IODIDE
SpectraBase Compound ID 5k9KLbS7GAg
InChI InChI=1S/C18H35N4.HI/c1-2-3-4-5-6-7-14-22-15-12-20-9-8-19-10-11-21(13-16-22)18(22)17(19)20;/h17-18H,2-16H2,1H3;1H/q+1;/p-1
InChIKey ZYBFHWBYKSJSLF-UHFFFAOYSA-M
Mol Weight 434.4 g/mol
Molecular Formula C18H35IN4
Exact Mass 434.190642 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQFYhTP6Qlr
Name (1RS,13SR,14RS)-1-OCTYL-4,7,10-TRIAZA-1-AZONIATETRACYCLO-[5.5.2.0.(4,14)0.(10,13)]-TETRADECANE-IODIDE
Compound Number 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H35IN4
InChI InChI=1S/C18H35N4.HI/c1-2-3-4-5-6-7-14-22-15-12-20-9-8-19-10-11-21(13-16-22)18(22)17(19)20;/h17-18H,2-16H2,1H3;1H/q+1;/p-1
InChIKey ZYBFHWBYKSJSLF-UHFFFAOYSA-M
Literature Reference Author W.C.BAKER,M.J.CHOI,D.C.HILL,J.L.THOMPSON,P.A.PETILLO
Literature Reference Citation J.ORG.CHEM.,64,2683(1999)
Literature Reference DOI 10.1021/jo981920r
Molecular Weight 434.407 g/mol
Sample ID 58553
Solvent CDCl3