Scopolamine Methyl Bromide

Analyte Name

Methscopolamine Bromide

CAS Number

155-41-9

Molecular Formula

C18 H24 N O4 . Br

Molecular Weight

398.29

Accurate Mass

397.0889

SMILES

[Br-].C[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/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/p-1/t12-,13-,14-,15+,16-,17+;/m1./s1

IUPAC

(1R,2R,4S,5S,7s)-7-[[(2S)-3-Hydroxy-2-phenylpropanoyl]oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Transport Restrictions

Air Excepted

Product Type

Impurity

Product Format

Neat

API Family

Scopolamine

Purity

>95% (HPLC)