Analyte Name

alpha,4-Dihydroxy-3-methoxy-alpha-methyl-benzeneethanesulfonic Acid Potassium Salt-d5

CAS Number

1794789-29-9

Molecular Formula

C10H8D5KO6S

Molecular Weight

305.4

Accurate Mass

305.0384

SMILES

[K+].[2H]C([2H])([2H])C(O)(C([2H])([2H])c1ccc([O-])c(OC)c1)S(=O)(=O)O

InChI

InChI=1S/C10H14O6S.K/c1-10(12,17(13,14)15)6-7-3-4-8(11)9(5-7)16-2;/h3-5,11-12H,6H2,1-2H3,(H,13,14,15);/q;+1/p-1/i1D3,6D2;

IUPAC

potassium;2-methoxy-4-(1,1,3,3,3-pentadeuterio-2-hydroxy-2-sulfopropyl)phenolate

Unlabelled CAS Number

1316753-66-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API

Product Format

Neat