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Phenylsulfate-[13C6] sodium salt

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General Information
Catalog: BLP-001168
Molecular Formula: [13C]6H5NaO4S
Molecular Weight: 202.11

Chemical Structure

IUPAC Name	sodium;(1,2,3,4,5,6-13C6)cyclohexatrienyl sulfate
Canonical SMILES	C1=CC=C(C=C1)OS(=O)(=O)[O-].[Na+]
InChI	InChI=1S/C6H6O4S.Na/c7-11(8,9)10-6-4-2-1-3-5-6;/h1-5H,(H,7,8,9);/q;+1/p-1/i1+1,2+1,3+1,4+1,5+1,6+1;
InChI Key	PNFSYNAUAPBVGF-BVNCJLROSA-M
Purity	98% by CP; 99% atom 13C