Anisotropine methylbromide

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Systematic / IUPAC Name: 8,8-Dimethyl-3-[(2-propylpentanoyl)oxy]-8-azoniabicyclo[3.2.1]octane

ID: Reference1884

Other Names:

Formula: C17H32NO2 +

Class: Therapeutics/Prescription Drugs

Spectral Data

Anisotropine methylbromide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 39
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/16/2015 11:18:45 AM
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Identificators

InChI InChI=1S/C17H32NO2/c1-5-7-13(8-6-2)17(19)20-16-11-14-9-10-15(12-16)18(14,3)4/h13-16H,5-12H2,1-4H3/q+1
InChI Key XGGHHHBGPSNXFE-UHFFFAOYSA-N
Canonical SMILES CCCC(CCC)C(=O)OC1CC2CCC(C1)[N+]2(C)C
CAS 80502
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Other Names

In Other Databases

PubChem 4157
ChemIDPlus 070642909
Wikipedia Octatropine methylbromide
ChEMBL CHEMBL368108
ChemSpider 4014