Analyte Name

7-Aminosuccinylbenzo[a]pyrene

CAS Number

1076198-86-1

Molecular Formula

C24 H17 N O3

Molecular Weight

367.40

Accurate Mass

367.1208

SMILES

OC(=O)CCC(=O)Nc1cccc2c3ccc4cccc5ccc(cc12)c3c45

InChI

InChI=1S/C24H17NO3/c26-21(11-12-22(27)28)25-20-6-2-5-17-18-10-9-15-4-1-3-14-7-8-16(13-19(17)20)24(18)23(14)15/h1-10,13H,11-12H2,(H,25,26)(H,27,28)

IUPAC

4-(benzo[a]pyren-7-ylamino)-4-oxobutanoic acid

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Contaminant

Product Format

Neat