Mono-[(2-carboxymethyl)hexyl]phthalate (unlabelled) (DEHP Metabolite IV) 100 µg/mL in MTBE

Analyte Name

Mono[2-(carboxymethyl)hexyl] Phthalate

CAS Number

82975-93-7

Molecular Formula

C16 H20 O6

Molecular Weight

308.33

Measured Value

100.0 µg/mL

Accurate Mass

308.126

SMILES

CCCCC(COC(=O)c1ccccc1C(=O)O)CC(=O)O

InChI

InChI=1S/C16H20O6/c1-2-3-6-11(9-14(17)18)10-22-16(21)13-8-5-4-7-12(13)15(19)20/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,18)(H,19,20)

IUPAC

2-[2-(carboxymethyl)hexoxycarbonyl]benzoic acid

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Transport Restrictions

Air Excepted

Product Format

Single Solution

Matrix

Methyl tert-butyl ether