Analyte Name

S-Propyl-5-nitro-2-thiobarbituric-d7 Acid

CAS Number

1265919-34-3

Molecular Formula

C6 D6 H2 N3 O4 S . C D

Molecular Weight

238.272

Accurate Mass

238.075

SMILES

[2H][C].[2H]C([2H])([2H])[2H]C([2H])([2H])SC1=NC(=C(C(=O)N1)[N+](=O)[O-])O

InChI

InChI=1S/C6H8N3O4S.CH/c1-15-2-14-6-7-4(10)3(9(12)13)5(11)8-6;/h2H2,1H3,(H2,7,8,10,11);1H/i1D3,2D2,15+1;1D

IUPAC

deuteriomethane;[dideuterio-[(4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)sulfanyl]methyl]-(trideuteriomethyl)(2H)deuterium

Unlabelled CAS Number

145783-13-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat