Analyte Name

(1R,6S)-rel-6-(2,3-Dichlorophenyl)-2-methyl-4-oxo-2-cyclohexene-1-carboxylic Acid Methyl Ester

CAS Number

1207068-17-4

Molecular Formula

C15H14Cl2O3

Molecular Weight

313.17

Accurate Mass

312.03

SMILES

C(OC)(=O)[C@H]1[C@@H](CC(=O)C=C1C)C2=C(Cl)C(Cl)=CC=C2

InChI

InChI=1/C15H14Cl2O3/c1-8-6-9(18)7-11(13(8)15(19)20-2)10-4-3-5-12(16)14(10)17/h3-6,11,13H,7H2,1-2H3/t11-,13+/s2

IUPAC

methyl (1R,2S)-2',3'-dichloro-3-methyl-5-oxo-1,2,5,6-tetrahydro-[1,1'-biphenyl]-2-carboxylate

Country of Origin

CANADA

Product Format

Neat