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SCOPOLAMINE-HBR-ANHYDRATE
SpectraBase Compound ID 9V87eEMOnym
InChI InChI=1S/C17H21NO4.BrH/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H/t11-,12-,13-,14+,15-,16+;/m1./s1
InChIKey WTGQALLALWYDJH-MOUKNHLCSA-N
Mol Weight 384.27 g/mol
Molecular Formula C17H22BrNO4
Exact Mass 383.073221 g/mol
Parent InChIKey STECJAGHUSJQJN-FWXGHANASA-N
Enantiomer InChIKey WTGQALLALWYDJH-GENQDRINSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID_STATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID-STATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
  • SCOPOLAMINE-HBR-AX-ME
  • SCOPOLAMINE-HBR-EQ-ME
Title Journal or Book Year
Conformational Pseudopolymorphism and Solid-State CPMAS NMR Studies for Determination of Solvent-Dependent Solution-State Conformational Preferences for (−)-Scopolamine Hydrobromide/Hydrochloride Salts The Journal of Organic Chemistry 1999

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