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2-(1,5-DIAMINO-3-AZABICYCLO-[3.3.1]-NONANE-3-YL)-1-BUTANOL_TRIHYDROCHLORIDE
SpectraBase Compound ID 6xFFWyIY3LZ
InChI InChI=1S/C12H25N3O.3ClH/c1-2-10(6-16)15-8-11(13)4-3-5-12(14,7-11)9-15;;;/h10,16H,2-9,13-14H2,1H3;3*1H
InChIKey LBRDXMPMHXGWCH-UHFFFAOYSA-N
Mol Weight 336.73 g/mol
Molecular Formula C12H28Cl3N3O
Exact Mass 335.129796 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4MCicjkfSnB
Name 2-(1,5-DIAMINO-3-AZABICYCLO-[3.3.1]-NONANE-3-YL)-1-BUTANOL_TRIHYDROCHLORIDE
Compound Number II-E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H28Cl3N3O
InChI InChI=1S/C12H25N3O.3ClH/c1-2-10(6-16)15-8-11(13)4-3-5-12(14,7-11)9-15;;;/h10,16H,2-9,13-14H2,1H3;3*1H
InChIKey LBRDXMPMHXGWCH-UHFFFAOYSA-N
Literature Reference Author M.V.KOPYSHEV,I.V.SHAKHKELDYAN,L.M.KOZLOVA,E.F.LITVIN,V.Z.SHA RF,N.A.TROITSKII,Y.M
Literature Reference Citation RUSS.J.ORG.CHEM.,40,255(2004)
Literature Reference DOI 10.1023/B:RUJO.0000034950.28394.e0
Molecular Weight 336.733 g/mol
Solvent D2O
Source File Reference UWMZ16490