Analyte Name

(R)-3-Benzoyloxy-2-(4-trifluoromethoxybenzyl-d2-oxy)propyl-1,1-d2 4-Toluenesulfonate

Molecular Formula

C25 D4 H19 F3 O7 S

Molecular Weight

528.531

Accurate Mass

528.137

SMILES

[2H]C([2H])(OS(=O)(=O)c1ccc(C)cc1)[C@H](COC(=O)c2ccccc2)OC([2H])([2H])c3ccc(OC(F)(F)F)cc3

InChI

InChI=1S/C25H23F3O7S/c1-18-7-13-23(14-8-18)36(30,31)34-17-22(16-33-24(29)20-5-3-2-4-6-20)32-15-19-9-11-21(12-10-19)35-25(26,27)28/h2-14,22H,15-17H2,1H3/t22-/m0/s1/i15D2,17D2

IUPAC

[(2S)-3,3-dideuterio-2-[dideuterio-[4-(trifluoromethoxy)phenyl]methoxy]-3-(4-methylphenyl)sulfonyloxypropyl] benzoate

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat