Analyte Name

[4-[(E)-(2,4-dihydroxyphenyl)diazenyl](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl]sulfonyloxysodium

Molecular Formula

13C6 C6 H9 N2 Na O5 S

Molecular Weight

322.221

Accurate Mass

322.033

SMILES

Oc1ccc(\N=N\[13c]2[13cH][13cH][13c]([13cH][13cH]2)S(=O)(=O)O[Na])c(O)c1

InChI

InChI=1S/C12H10N2O5S.Na/c15-9-3-6-11(12(16)7-9)14-13-8-1-4-10(5-2-8)20(17,18)19;/h1-7,15-16H,(H,17,18,19);/q;+1/p-1/b14-13+;/i1+1,2+1,4+1,5+1,8+1,10+1;

IUPAC

[4-[(E)-(2,4-dihydroxyphenyl)diazenyl](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl]sulfonyloxysodium

Unlabelled CAS Number

547-57-9

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat