Analyte Name

7-Desmethyl-3-hydroxyagomelatine-d3

Molecular Formula

C14 D3 H12 N O3

Molecular Weight

248.292

Accurate Mass

248.124

SMILES

[2H]C([2H])([2H])C(=O)NCCc1cc(O)cc2ccc(O)cc12

InChI

InChI=1S/C14H15NO3/c1-9(16)15-5-4-11-7-13(18)6-10-2-3-12(17)8-14(10)11/h2-3,6-8,17-18H,4-5H2,1H3,(H,15,16)/i1D3

IUPAC

2,2,2-trideuterio-N-[2-(3,7-dihydroxynaphthalen-1-yl)ethyl]acetamide

Unlabelled CAS Number

166527-00-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat