Analyte Name

3-(Methyl-d3)-L-Valine-4,4,4,4',4',4'-d6 Hydrochloride

CAS Number

1092540-48-1

Molecular Formula

C6H4D9NO2 . HCl

Molecular Weight

176.69

Accurate Mass

176.13

SMILES

[2H]C([2H])([2H])C([C@H](N)C(O)=O)(C([2H])([2H])[2H])C([2H])([2H])[2H].Cl

InChI

InChI=1S/C6H13NO2.ClH/c1-6(2,3)4(7)5(8)9;/h4H,7H2,1-3H3,(H,8,9);1H/t4-;/m1./s1/i1D3,2D3,3D3;

IUPAC

(S)-2-amino-3,3-bis(methyl-d3)butanoic-4,4,4-d3 acid hydrochloride

Alternate CAS Number

Free Base: 1092649-91-6

Unlabelled CAS Number

1092649-91-6

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API

Product Format

Neat