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Cinchonine

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

Cinchonine
SpectraBase Compound ID Brbb0GVRpF4
InChI InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1
InChIKey KMPWYEUPVWOPIM-QAMTZSDWSA-N
Mol Weight 294.4 g/mol
Molecular Formula C19H22N2O
Exact Mass 294.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5n2hclSY5L
Name Cinchonine
Alternate Name(s) (9S)-Cinchonan-9-ol (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(4-quinolinyl)methanol (S)-4-quinolyl-[(2R,4S,5R)-5-vinylquinuclidin-2-yl]methanol (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol Cinchonan-9-ol (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-yl-methanol
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Formula C19H22N2O
InChI InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1
InChIKey KMPWYEUPVWOPIM-QAMTZSDWSA-N
Molecular Weight 294.398 g/mol
SMILES O[C@@](c1c2c(cccc2)ncc1)([C@@]1(N2C[C@](C=C)([C@](CC2)([H])C1)[H])[H])[H]
SPLASH splash10-000l-0950000000-fb11308f77ed28cbd6aa
Source of Spectrum DB-1-220-0
Wiley ID 815235