Analyte Name

2-Acetamido-2-(4-octylphenethyl)malonic Acid

Molecular Formula

C21 H31 N O5

Molecular Weight

377.474

Accurate Mass

377.22

SMILES

CCCCCCCCc1ccc(CCC(NC(=O)C)(C(=O)O)C(=O)O)cc1

InChI

InChI=1S/C21H31NO5/c1-3-4-5-6-7-8-9-17-10-12-18(13-11-17)14-15-21(19(24)25,20(26)27)22-16(2)23/h10-13H,3-9,14-15H2,1-2H3,(H,22,23)(H,24,25)(H,26,27)

IUPAC

2-acetamido-2-[2-(4-octylphenyl)ethyl]propanedioic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat