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Cinchonine AC
SpectraBase Compound ID 4G873oT8Fz1
InChI InChI=1S/C21H24N2O2/c1-3-15-13-23-11-9-16(15)12-20(23)21(25-14(2)24)18-8-10-22-19-7-5-4-6-17(18)19/h3-8,10,15-16,20-21H,1,9,11-13H2,2H3
InChIKey NDBICTMGDYGBFE-UHFFFAOYSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VactQQ0I7R
Name Cinchonan-9-yl acetate
Alternate Name(s) Cinchonine acetate Acetic acid [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(4-quinolinyl)methyl] ester [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethyl] acetate [4-quinolyl-(5-vinylquinuclidin-2-yl)methyl] acetate [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] ethanoate
CAS Registry Number 14461-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O2
InChI InChI=1S/C21H24N2O2/c1-3-15-13-23-11-9-16(15)12-20(23)21(25-14(2)24)18-8-10-22-19-7-5-4-6-17(18)19/h3-8,10,15-16,20-21H,1,9,11-13H2,2H3
InChIKey NDBICTMGDYGBFE-UHFFFAOYSA-N
Molecular Weight 336.435 g/mol
SMILES C(OC(=O)C)(C1N2CCC(C(C=C)C2)C1)c1ccnc2c1cccc2
SPLASH splash10-000i-7900000000-508a2058fe04f5cfb8bf
Source of Spectrum NP-12-700-0
Wiley ID 1110072