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quinidine, monohydrate

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quinidine, monohydrate
SpectraBase Compound ID 8tjWqqDVfb1
InChI InChI=1S/C20H24N2O2.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;1H2/t13-,14-,19-,20+;/m0./s1
InChIKey NGXLOCPSRZVKMI-DSXUQNDKSA-N
Mol Weight 342.439 g/mol
Molecular Formula C20H26N2O3
Exact Mass 342.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uwPtCBabM0
Name QUININE, MONOHYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O2 H2O
InChI InChI=1S/C20H24N2O2.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;1H2/t13-,14-,19-,20+;/m0./s1
InChIKey NGXLOCPSRZVKMI-DSXUQNDKSA-N
Melting Point 173-175C
Molecular Weight 342.44
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms QUININE, HYDRATED QUINIDINE, HYDRATED 4-QUINOLINEMETHANOL, 6-METHOXY-A- /5-VINYL-2-QUINUCLIDINYL/-, HYDRATED