| 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 |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 13xsJCb69Lc |
|---|---|
| Name | quinine, dihydrochloride, monohydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28Cl2N2O3 |
| 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 |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 49961M |
| Solvent | DMSO-d6 |