Analyte Name

3,5-Di-O-p-chlorobenzoyl Floxuridine-13C,15N2

Molecular Formula

13C C22 H17 Cl2 F 15N2 O7

Molecular Weight

526.274

Accurate Mass

525.037

SMILES

FC1=C[15N]([C@H]2C[C@H](OC(=O)c3ccc(Cl)cc3)[C@@H](COC(=O)c4ccc(Cl)cc4)O2)[13C](=O)[15NH]C1=O

InChI

InChI=1S/C23H17Cl2FN2O7/c24-14-5-1-12(2-6-14)21(30)33-11-18-17(35-22(31)13-3-7-15(25)8-4-13)9-19(34-18)28-10-16(26)20(29)27-23(28)32/h1-8,10,17-19H,9,11H2,(H,27,29,32)/t17-,18+,19+/m0/s1/i23+1,27+1,28+1

IUPAC

[(2R,3S,5R)-3-(4-chlorobenzoyl)oxy-5-(5-fluoro-2,4-dioxo(213C,1,3-15N2)pyrimidin-1-yl)oxolan-2-yl]methyl 4-chlorobenzoate

Unlabelled CAS Number

1582-79-2

SIL Type

Nitrogen, Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat