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acetic acid [(1R)-1-[(12bS)-5-oxido-1,4,6,7,12,12b-hexahydropyrido[6,1-a]$b-carbolin-5-ium-3-yl]ethyl] ester
SpectraBase Compound ID 4GQVzXkDcWr
InChI InChI=1S/C19H22N2O3/c1-12(24-13(2)22)14-7-8-18-19-16(9-10-21(18,23)11-14)15-5-3-4-6-17(15)20-19/h3-7,12,18,20H,8-11H2,1-2H3/t12-,18+,21?/m1/s1
InChIKey OHTRAYALCWCBNZ-ARBCDQEWSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ZsGb2tDZ1L
Name acetic acid [(1R)-1-[(12bS)-5-oxido-1,4,6,7,12,12b-hexahydropyrido[6,1-a]$b-carbolin-5-ium-3-yl]ethyl] ester
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-12(24-13(2)22)14-7-8-18-19-16(9-10-21(18,23)11-14)15-5-3-4-6-17(15)20-19/h3-7,12,18,20H,8-11H2,1-2H3/t12-,18+,21?/m1/s1
InChIKey OHTRAYALCWCBNZ-ARBCDQEWSA-N
Literature Reference Author M.LOUNASMAA,P.HANHINEN,S.LIPPONEN
Literature Reference Citation HETEROCYCLES,43,1365(1996)
Literature Reference DOI 10.3987/COM-96-7446
Molecular Weight 326.395 g/mol
Solvent CDCl3+5-DROPS-CD3OD
Source File Reference UWCP5883