Analyte Name

Sodium 1,2-Benzisoxazole-3-methanesulfonate-d4

Molecular Formula

C8 D4 H2 N Na O4 S

Molecular Weight

239.217

Accurate Mass

239.017

SMILES

[2H]c1c([2H])c([2H])c2c(CS(=O)(=O)O[Na])noc2c1[2H]

InChI

InChI=1S/C8H7NO4S.Na/c10-14(11,12)5-7-6-3-1-2-4-8(6)13-9-7;/h1-4H,5H2,(H,10,11,12);/q;+1/p-1/i1D,2D,3D,4D;

IUPAC

(4,5,6,7-tetradeuterio-1,2-benzoxazol-3-yl)methylsulfonyloxysodium

Unlabelled CAS Number

73101-64-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat