Analyte Name

Hyoscine N-Oxide Hydrobromide

CAS Number

6106-81-6

Molecular Formula

C17 H21 N O5 . Br H

Molecular Weight

400.26

Accurate Mass

399.0681

SMILES

Br.C[N+]1([O-])[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)[C@H](CO)c4ccccc4

InChI

InChI=1S/C17H21NO5.BrH/c1-18(21)13-7-11(8-14(18)16-15(13)23-16)22-17(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+,18?;/m1./s1

IUPAC

(aS)-a-(Hydroxymethyl)benzeneacetic acid (1a,2ß,4ß,5a,7ß)-9-methyl-3-oxa-9-oxido-9-azatricyclo[3.3.1.02,4]non-7-yl ester hydrobromide

Storage Temperature

+5°C

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Hyoscine Hydrobromide (Scopolamine Hydrobromide)