Analyte Name

N-Desmethyl Alosetron-d4

Molecular Formula

C16 D4 H12 N4 O

Molecular Weight

284.349

Accurate Mass

284.158

SMILES

[2H]c1nc(CN2CCc3[nH]c4ccccc4c3C2=O)c([nH]1)C([2H])([2H])[2H]

InChI

InChI=1S/C16H16N4O/c1-10-14(18-9-17-10)8-20-7-6-13-15(16(20)21)11-4-2-3-5-12(11)19-13/h2-5,9,19H,6-8H2,1H3,(H,17,18)/i1D3,9D

IUPAC

2-[[2-deuterio-5-(trideuteriomethyl)-1H-imidazol-4-yl]methyl]-4,5-dihydro-3H-pyrido[4,3-b]indol-1-one

Unlabelled CAS Number

122852-63-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat