Analyte Name

1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-3-quinolinecarboxylic Acid Ethyl Ester-d5

Molecular Formula

C15 D5 H8 F2 N O4

Molecular Weight

314.296

Accurate Mass

314.113

SMILES

[2H]C([2H])([2H])C([2H])([2H])OC(=O)C1=CN(C2CC2)c3c(O)c(F)c(F)cc3C1=O

InChI

InChI=1S/C15H13F2NO4/c1-2-22-15(21)9-6-18(7-3-4-7)12-8(13(9)19)5-10(16)11(17)14(12)20/h5-7,20H,2-4H2,1H3/i1D3,2D2

IUPAC

1,1,2,2,2-pentadeuterioethyl 1-cyclopropyl-6,7-difluoro-8-hydroxy-4-oxoquinoline-3-carboxylate

Unlabelled CAS Number

452092-31-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat