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Product Overview

Product Code

TRC-S200020

CAS Number

97-75-6

Product Format

Neat

Molecular Formula

C17H21NO5

Molecular Weight

319.35

API Family

Scopolamine

Product Categories

TRC, Reference Materials for Cocaine and Related Substances , Impurity Reference Materials

Product Type

Impurity

Alternate CAS Number

Hydrobromide salt: 6106-81-6

Documentation

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Product Information

Chemical Data

Analyte Name

Scopolamine N-Oxide

CAS Number

97-75-6

Molecular Formula

C17H21NO5

Molecular Weight

319.35

Accurate Mass

319.142

SMILES

O=C([C@H](CO)C1=CC=CC=C1)O[C@H]2C[C@H]3[C@H](O4)[C@H]4[C@@H](C2)N3(C)=O

InChI

InChI=1S/C17H21NO5/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/t11-,12-,13-,14+,15-,16+,18+/m1/s1

IUPAC

[(1R,2R,4S,5S)-9-methyl-9-oxido-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-3-hydroxy-2-phenylpropanoate

Alternate CAS Number

Hydrobromide salt: 6106-81-6

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Scopolamine

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