Analyte Name

1-Acetoxy-4-(N-acetyl-L-cysteinyl)-2-butanone-D6

Molecular Formula

C11 D6 H11 N O6 S

Molecular Weight

297.358

Accurate Mass

297.115

SMILES

[2H]C([2H])(OC(=O)C)C(=O)C([2H])([2H])C([2H])([2H])SCC(NC(=O)C)C(=O)O

InChI

InChI=1S/C11H17NO6S/c1-7(13)12-10(11(16)17)6-19-4-3-9(15)5-18-8(2)14/h10H,3-6H2,1-2H3,(H,12,13)(H,16,17)/i3D2,4D2,5D2

IUPAC

2-acetamido-3-(4-acetyloxy-1,1,2,2,4,4-hexadeuterio-3-oxobutyl)sulfanylpropanoic acid

Unlabelled CAS Number

144889-52-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat