Analyte Name

7-Chloro-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Ethyl-d5 Ester

Molecular Formula

C14 D5 H8 Cl F N O3

Molecular Weight

302.74

Accurate Mass

302.088

SMILES

[2H]C([2H])([2H])C([2H])([2H])N1C=C(C(=O)OCC)C(=O)c2cc(F)c(Cl)cc12

InChI

InChI=1S/C14H13ClFNO3/c1-3-17-7-9(14(19)20-4-2)13(18)8-5-11(16)10(15)6-12(8)17/h5-7H,3-4H2,1-2H3/i1D3,3D2

IUPAC

ethyl 7-chloro-6-fluoro-4-oxo-1-(1,1,2,2,2-pentadeuterioethyl)quinoline-3-carboxylate

Alternate CAS Number

70458-94-5

Unlabelled CAS Number

70458-94-5

SIL Type

Deuterium

Storage Temperature

+20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat