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Product Overview

Product Code

CDN-D-7810

Product Format

Neat

Molecular Formula

C15 D15 H2 Br2 N O2

Molecular Weight

418.2014

Product Categories

Pesticide & Metabolite Reference Materials and Research Chemicals , Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1689-99-2

Purity

98 atom % D, min 98% Chemical Purity

Documentation

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Product Information

Analyte Data

Analyte Name

Bromoxynil Octanoate-D15

Molecular Formula

C15 D15 H2 Br2 N O2

Molecular Weight

418.2014

Accurate Mass

416.0568

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)Oc1c(Br)cc(cc1Br)C#N

InChI

InChI=1S/C15H17Br2NO2/c1-2-3-4-5-6-7-14(19)20-15-12(16)8-11(10-18)9-13(15)17/h8-9H,2-7H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2,7D2

IUPAC

(2,6-dibromo-4-cyanophenyl) 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecadeuteriooctanoate

Unlabelled CAS Number

1689-99-2

SIL Type

Deuterium

Product Data

Storage Temperature

Room Temperature

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

98 atom % D, min 98% Chemical Purity

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Product Overview

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Analyte Data

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2,6-Dibromo-4-cyanophenyl Octanoate-d15

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