Analyte Name

(4S)-3-[(2R,5S)-5-(4-Fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino][4-[(trimethylsilyl)oxy]phenyl]methyl]-1-oxo-5-[(trimethylsilyl)oxy]pentyl]-4-phenyl-2-oxazolidinone-13C6

Molecular Formula

13C6 C33 H46 F2 N2 O5 Si2

Molecular Weight

722.917

Accurate Mass

722.311

SMILES

C[Si](C)(C)O[C@@H](CC[C@H]([C@H](Nc1ccc(F)cc1)[13c]2[13cH][13cH][13c](O[Si](C)(C)C)[13cH][13cH]2)C(=O)N3[C@@H](COC3=O)c4ccccc4)c5ccc(F)cc5

InChI

InChI=1S/C39H46F2N2O5Si2/c1-49(2,3)47-33-22-14-29(15-23-33)37(42-32-20-18-31(41)19-21-32)34(24-25-36(48-50(4,5)6)28-12-16-30(40)17-13-28)38(44)43-35(26-46-39(43)45)27-10-8-7-9-11-27/h7-23,34-37,42H,24-26H2,1-6H3/t34-,35+,36+,37-/m1/s1/i14+1,15+1,22+1,23+1,29+1,33+1

IUPAC

(4R)-3-[(2R,5S)-2-[(S)-(4-fluoroanilino)-(4-trimethylsilyloxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)methyl]-5-(4-fluorophenyl)-5-trimethylsilyloxypentanoyl]-4-phenyl-1,3-oxazolidin-2-one

Alternate CAS Number

272778-12-8

Unlabelled CAS Number

272778-12-8

SIL Type

Carbon

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat