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Quinine  (anhydrous)
SpectraBase Compound ID 6s2iLnhXzxf
InChI InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1
InChIKey LOUPRKONTZGTKE-WZBLMQSHSA-N
Mol Weight 324.42 g/mol
Molecular Formula C20H24N2O2
Exact Mass 324.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPwkVFRwEde
Name (8alpha,9R)-6'-methoxycinchonan-9-ol
Alternate Name(s) (R)-(6-methoxy-4-quinolyl)-[(2S,4S,5R)-5-vinylquinuclidin-2-yl]methanol (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxy-4-quinolinyl)methanol (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol Quinine
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Formula C20H24N2O2
InChI InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1
InChIKey LOUPRKONTZGTKE-WZBLMQSHSA-N
Molecular Weight 324.424 g/mol
SMILES O[C@](c1c2c(ccc(c2)OC)ncc1)([C@]1(N2C[C@](C=C)([C@](CC2)([H])C1)[H])[H])[H]
SPLASH splash10-000i-0900000000-58c2f5642ce48aaef2ff
Source of Spectrum O-35-713-11
Wiley ID 818211