| SpectraBase Compound ID | Jn5KOrpLemE |
|---|---|
| InChI | InChI=1S/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19-,20+;;;/m00.../s1 |
| InChIKey | ZHNFLHYOFXQIOW-LPYZJUEESA-N |
| Mol Weight | 782.95 g/mol |
| Molecular Formula | C40H54N4O10S |
| Exact Mass | 782.356065 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | 23M9qDAIGiE |
|---|---|
| Name | Quinine hemisulfate salt monohydrate |
| Source of Sample | Aldrich |
| Catalog Number | 145912 |
| CAS Registry Number | 207671-44-1 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24N2O2*0.5H2O4S*H2O |
| InChI | InChI=1S/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19-,20+;;;/m00.../s1 |
| InChIKey | ZHNFLHYOFXQIOW-LPYZJUEESA-N |
| Purity | 90% |
| Synonyms | Quinine sulfate (2:1) (salt) dihydrate |
| Wiley ID | SIAL_ATR-IR_008308 |