N-[2-(Indol-3-yl-2,4,5,6,7-d5)acetyl]-L-aspartic-15N Acid

Analyte Name

N-[2-(Indol-3-yl-2,4,5,6,7-d5)acetyl]-L-aspartic-15N Acid

CAS Number

1201012-71-6

Molecular Formula

C14 D5 H9 15N N O5

Molecular Weight

296.296

Accurate Mass

296.119

SMILES

[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1CC(=O)[15NH][C@@H](CC(=O)O)C(=O)O

InChI

InChI=1S/C14H14N2O5/c17-12(16-11(14(20)21)6-13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)/t11-/m0/s1/i1D,2D,3D,4D,7D,16+1

IUPAC

(2S)-2-[[2-(2,4,5,6,7-pentadeuterio-1H-indol-3-yl)acetyl](15N)amino]butanedioic acid

SIL Type

Nitrogen, Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat