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1-PENTYL-1,3,6,8-TETRAAZATRICYCLO-[4.3.1.1(3,8)]-UNDECAN-1-IUM-IODIDE
SpectraBase Compound ID BM4BFNoOaTr
InChI InChI=1S/C12H25N4.HI/c1-2-3-4-7-16-10-13-5-6-14(11-16)9-15(8-13)12-16;/h2-12H2,1H3;1H/q+1;/p-1
InChIKey KBAOERYGNHQKEY-UHFFFAOYSA-M
Mol Weight 352.26 g/mol
Molecular Formula C12H25IN4
Exact Mass 352.112392 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2H0Jgwq5zqT
Name 1-PENTYL-1,3,6,8-TETRAAZATRICYCLO-[4.3.1.1(3,8)]-UNDECAN-1-IUM-IODIDE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H25IN4
InChI InChI=1S/C12H25N4.HI/c1-2-3-4-7-16-10-13-5-6-14(11-16)9-15(8-13)12-16;/h2-12H2,1H3;1H/q+1;/p-1
InChIKey KBAOERYGNHQKEY-UHFFFAOYSA-M
Literature Reference Author A.RIVERA,J.SADAT-BERNAL,J.RIOS-MOTTA,M.DUSEK,L.PALATINUS
Literature Reference Citation CHEM.CENTR.J.,5,55,1(2011)
Literature Reference DOI 10.1186/1752-153x-5-55
Molecular Weight 352.262 g/mol
Solvent D2O
Source File Reference UWIR11762