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Product Overview

Product Code

TRC-M526602

CAS Number

1398066-18-6

Product Format

Neat

Molecular Formula

C14 D4 H12 O4

Molecular Weight

252.299

Product Categories

Phthalates, Stable isotopes, Stable Isotope Labelled Analytical Standards, Impurity Reference Materials , TRC, Food contact materials

Product Type

Stable Isotope Labelled, Metabolite, Contaminant

Unlabelled CAS Number

7517-36-4

Documentation

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Product Information

Chemical Data

Analyte Name

Monocyclohexyl Phthalate-d4

CAS Number

1398066-18-6

Molecular Formula

C14 D4 H12 O4

Molecular Weight

252.299

Accurate Mass

252.13

SMILES

[2H]c1c([2H])c([2H])c(C(=O)OC2CCCCC2)c(C(=O)O)c1[2H]

InChI

InChI=1S/C14H16O4/c15-13(16)11-8-4-5-9-12(11)14(17)18-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,15,16)/i4D,5D,8D,9D

IUPAC

2-cyclohexyloxycarbonyl-3,4,5,6-tetradeuteriobenzoic acid

Unlabelled CAS Number

7517-36-4

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

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