Product Code

TRC-B415097

Product Format

Neat

Molecular Formula

C11H6D3N3O5

Molecular Weight

266.23

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1364322-41-7

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

N,N-Bis-desethyl, N-Methyl Entacapone-d3

Molecular Formula

C11H6D3N3O5

Molecular Weight

266.23

Accurate Mass

266.07

SMILES

OC1=C(O)C([N+]([O-])=O)=CC(/C=C(C#N)/C(NC([2H])([2H])[2H])=O)=C1

InChI

InChI=1S/C11H9N3O5/c1-13-11(17)7(5-12)2-6-3-8(14(18)19)10(16)9(15)4-6/h2-4,15-16H,1H3,(H,13,17)/b7-2+/i1D3

IUPAC

(E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N-(methyl-d3)acrylamide

Unlabelled CAS Number

1364322-41-7

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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