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Product Overview

Product Code

TRC-D291412

CAS Number

1185245-14-0

Product Format

Neat

Molecular Formula

C21 2H7 H16 N O2

Molecular Weight

328.46

Product Categories

TRC, Allylamines, Stable isotopes, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Bioactive small molecule, Stable Isotope Labelled, API

Unlabelled CAS Number

1798428-57-5

Product Information

Chemical Data

Analyte Name

N-Desmethylcarboxy Terbinafine-d7 Methyl Ester

CAS Number

1185245-14-0

Molecular Formula

C21 2H7 H16 N O2

Molecular Weight

328.46

Accurate Mass

328.2168

SMILES

[2H]c1c([2H])c([2H])c2c(CNC\C=C\C#CC(C)(C)C(=O)OC)c([2H])c([2H])c([2H])c2c1[2H]

InChI

InChI=1S/C21H23NO2/c1-21(2,20(23)24-3)14-7-4-8-15-22-16-18-12-9-11-17-10-5-6-13-19(17)18/h4-6,8-13,22H,15-16H2,1-3H3/b8-4+/i5D,6D,9D,10D,11D,12D,13D

IUPAC

methyl (E)-7-[(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)methylamino]-2,2-dimethylhept-5-en-3-ynoate

Unlabelled CAS Number

1798428-57-5

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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