Phenylbutazone-d9

Analyte Name

Phenylbutazone-d9

CAS Number

1189479-75-1

Molecular Formula

C19 2H9 H11 N2 O2

Molecular Weight

317.43

Accurate Mass

317.209

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3

InChI

InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3/i1D3,2D2,3D2,14D2

IUPAC

4-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)-1,2-diphenylpyrazolidine-3,5-dione

Unlabelled CAS Number

50-33-9

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Phenylbutazone

Purity

>95% (HPLC)