Analyte Name

2-bromo-N-(((2-bromo-1,1,2,2-tetradeuterioethyl)amino)-((3-methyl-2-nitroimidazol-4-yl)methoxy)phosphoryl)-1,1,2,2-tetradeuterioethanamine

CAS Number

918632-75-4

Molecular Formula

C9 D8 H8 Br2 N5 O4 P

Molecular Weight

457.086

Accurate Mass

454.981

SMILES

[2H]C([2H])(Br)C([2H])([2H])NP(=O)(NC([2H])([2H])C([2H])([2H])Br)OCc1cnc([N+](=O)[O-])n1C

InChI

InChI=1S/C9H16Br2N5O4P/c1-15-8(6-12-9(15)16(17)18)7-20-21(19,13-4-2-10)14-5-3-11/h6H,2-5,7H2,1H3,(H2,13,14,19)/i2D2,3D2,4D2,5D2

IUPAC

2-bromo-N-[[(2-bromo-1,1,2,2-tetradeuterioethyl)amino]-[(3-methyl-2-nitroimidazol-4-yl)methoxy]phosphoryl]-1,1,2,2-tetradeuterioethanamine

Unlabelled CAS Number

918633-87-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat