Monoisobutyl Phthalate-d4

Analyte Name

Monoisobutyl phthalate-d4

CAS Number

1219802-26-2

Molecular Formula

C12 2H4 H10 O4

Molecular Weight

226.26

Accurate Mass

226.1143

SMILES

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

InChI

InChI=1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14)/i3D,4D,5D,6D

IUPAC

2,3,4,5-tetradeuterio-6-(2-methylpropoxycarbonyl)benzoic acid

Unlabelled CAS Number

30833-53-5

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)