N-Butylscopolammonium Bromide

Analyte Name

Hyoscine Butylbromide

CAS Number

149-64-4

Molecular Formula

C21 H30 N O4 . Br

Molecular Weight

440.37

Accurate Mass

439.1358

Flash Point

0

SMILES

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

InChI

InChI=1S/C21H30NO4.BrH/c1-3-4-10-22(2)17-11-15(12-18(22)20-19(17)26-20)25-21(24)16(13-23)14-8-6-5-7-9-14;/h5-9,15-20,23H,3-4,10-13H2,1-2H3;1H/q+1;/p-1/t15-,16-,17-,18+,19-,20+,22+;/m1./s1

IUPAC

(1a,2ß,4ß,5a,7ß)-9-Butyl-7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Hyoscine Butylbromide

Purity

>95% (HPLC)