Entacapone-d10

Analyte Name

Entacapone-d10

CAS Number

1185241-19-3

Molecular Formula

C14 D10 H5 N3 O5

Molecular Weight

315.348

Accurate Mass

315.164

SMILES

[2H]C([2H])([2H])C([2H])([2H])N(C(=O)C(=Cc1cc(O)c(O)c(c1)[N+](=O)[O-])C#N)C([2H])([2H])C([2H])([2H])[2H]

InChI

InChI=1S/C14H15N3O5/c1-3-16(4-2)14(20)10(8-15)5-9-6-11(17(21)22)13(19)12(18)7-9/h5-7,18-19H,3-4H2,1-2H3/i1D3,2D3,3D2,4D2

IUPAC

2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-bis(1,1,2,2,2-pentadeuterioethyl)prop-2-enamide

Unlabelled CAS Number

130929-57-6

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

Entacapone

Purity

>95% (HPLC)