For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

quinine, dihydrochloride, monohydrate

View entire compound with spectra: 2 NMR, and 1 FTIR

quinine, dihydrochloride, monohydrate
SpectraBase Compound ID CHYjLqn5959
InChI InChI=1S/C20H24N2O2.2ClH.H2O/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;2*1H;1H2/t13-,14-,19-,20+;;;/m0.../s1
InChIKey FJOBXTBQDSJADF-FLZPLBAKSA-N
Mol Weight 415.361 g/mol
Molecular Formula C20H28Cl2N2O3
Exact Mass 414.147698 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3lg4VF0rII4
Name QUININE, DIHYDROCHLORIDE, MONOHYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O2 2HCl H2O
InChI InChI=1S/C20H24N2O2.2ClH.H2O/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;2*1H;1H2/t13-,14-,19-,20+;;;/m0.../s1
InChIKey FJOBXTBQDSJADF-FLZPLBAKSA-N
Melting Point 238-240C (dec.)
Molecular Weight 415.36
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms QUININE, DIHYDROCHLORIDE, MONOHYDRATE