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Product Overview

Product Code

TRC-V590940

CAS Number

2306217-16-1

Product Format

Neat

Molecular Formula

C28H26N6O

Molecular Weight

462.55

Product Categories

TRC

Product Information

Analyte Name

1-(1-Vareniclinylacetyl)-Varenicline

CAS Number

2306217-16-1

Molecular Formula

C28H26N6O

Molecular Weight

462.55

Accurate Mass

462.2168

SMILES

O=C(N1CC2C=3C=C4N=CC=NC4=CC3C(C1)C2)CN5CC6C=7C=C8N=CC=NC8=CC7C(C5)C6

InChI

InChI=1S/C28H26N6O/c35-28(34-13-18-6-19(14-34)23-10-27-26(9-22(18)23)31-3-4-32-27)15-33-11-16-5-17(12-33)21-8-25-24(7-20(16)21)29-1-2-30-25/h1-4,7-10,16-19H,5-6,11-15H2

IUPAC

1,2-bis(5,8,14-triazatetracyclo[10.3.1.02,11.04,9]hexadeca-2,4,6,8,10-pentaen-14-yl)ethanone

Country of Origin

CANADA

Product Format

Neat

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