Analyte Name

Monoundecyl Phthalate-3,4,5,6-D4

CAS Number

2733718-42-6

Molecular Formula

C19 D4 H24 O4

Molecular Weight

324.448

Accurate Mass

324.224

SMILES

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

InChI

InChI=1S/C19H28O4/c1-2-3-4-5-6-7-8-9-12-15-23-19(22)17-14-11-10-13-16(17)18(20)21/h10-11,13-14H,2-9,12,15H2,1H3,(H,20,21)/i10D,11D,13D,14D

IUPAC

2,3,4,5-tetradeuterio-6-undecoxycarbonylbenzoic acid

Unlabelled CAS Number

51622-03-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat