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Product Overview

Product Code

TRC-M831402

Product Format

Neat

Molecular Formula

C15 D9 H8 Cl N4

Molecular Weight

297.831

Product Categories

TRC, Fungicides and metabolites, Infectious Disease Research Chemicals and Analytical Standards, Pharmaceutical Toxicology Reference Materials , Pesticide & Metabolite Reference Materials and Research Chemicals

Product Type

Stable Isotope Labelled, Contaminant

Unlabelled CAS Number

88671-89-0

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Myclobutanil-d9

Molecular Formula

C15 D9 H8 Cl N4

Molecular Weight

297.831

Accurate Mass

297.171

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(Cn1cncn1)(C#N)c2ccc(Cl)cc2

InChI

InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3/i1D3,2D2,3D2,8D2

IUPAC

2-(4-chlorophenyl)-3,3,4,4,5,5,6,6,6-nonadeuterio-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile

Unlabelled CAS Number

88671-89-0

SIL Type

Deuterium

Product Data

Storage Temperature

+20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)

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