Analyte Name

2-Hydroxy-6-(4-hydroxyphenethyl)-benzoic acid-13C6

Molecular Formula

C9 13C6 H14 O4

Molecular Weight

264.23

Accurate Mass

264.11

SMILES

O[13C]([13C]([H])=[13C]1[H])=[13C]([H])[13C]([H])=[13C]1CCC2=C(C(O)=CC=C2)C(O)=O

InChI

InChI=1S/C15H14O4/c16-12-8-5-10(6-9-12)4-7-11-2-1-3-13(17)14(11)15(18)19/h1-3,5-6,8-9,16-17H,4,7H2,(H,18,19)/i5+1,6+1,8+1,9+1,10+1,12+1

IUPAC

2-Hydroxy-6-(2-(4-hydroxyphenyl-1,2,3,4,5,6-13C6)ethyl)benzoic acid

SIL Type

Carbon

Country of Origin

CANADA

Product Format

Neat