(-)-Ecgonine Methyl Ester Hydrochloride (1.0mg/ml in Acetonitrile)

Analyte Name

Methyl ecgonine hydrochloride

CAS Number

38969-40-3

Molecular Formula

C10 H17 N O3 . Cl H

Molecular Weight

235.71

Accurate Mass

235.0975

SMILES

Cl.COC(=O)[C@H]1[C@@H](O)C[C@@H]2CC[C@H]1N2C

InChI

InChI=1S/C10H17NO3.ClH/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2;/h6-9,12H,3-5H2,1-2H3;1H/t6-,7+,8-,9+;/m0./s1

IUPAC

methyl (1S,3S,4R,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate;hydrochloride

Alternate CAS Number

Free base: 7143-09-1

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Acetonitrile