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

*Links on SpectraBase are not permalinks.

SCOPOLAMINE-HBR-ANHYDRATE

Compound with spectra: 6 NMR

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

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID_STATE

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID-STATE

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2

View Spectrum of SCOPOLAMINE-HBR-ANHYDRATE

13C NMR Spectrum
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
2-phenylhydracrylic acid, 6 beta, 7 beta-epoxy-1alpha H, 5 alpha H-tropan-3 alpha-yl ester, hydrochloride
HYOSCIN-HYDROBROMID,(SCOPOLAMIN)
Scopolamine HBr monohydrate
Scopolamine hydrobromide hydrate
6beta,7beta-epoxy-1alphaH,5alphaH-tropan-3alpha-ol, (-)-tropate (ester), hydrobromide, trihydrate
Scopolaminium cation
STECJAGHUSJQJN-QBMZJCKTSA-N
Scopolamine-A (-H2O)
OXITROPIUM-ARTIFACT 2
Propanoic acid, 2-methyl-, 3-(acetyloxy)-8-methyl-8-azabicyclo[3.2.1]oct-6-yl ester, (3-endo,6-exo)-(.+-.)-
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

This compound is available in the following databases:

KnowItAll NMR Spectral Library
Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley

The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.

Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.