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Octachlorodibenzo-p-dioxin-[13C12]

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General Information
Catalog: BLP-008553
CAS: 114423-97-1
Molecular Formula: [13C]12Cl8O2
Molecular Weight: 471.66

Chemical Structure

Description	Octachlorodibenzo-p-dioxin-[13C12] is an isotopically labelled analog of Octachlorodibenzo-p-dioxin, a toxic polychlorinated dibenzo-p-dioxin detected in domestic meat and poultry.
Synonyms	1,2,3,4,6,7,8,9-Octachlorodibenzo[b,e][1,4]dioxin-13C12; D 75-13C12; NSC 37651-13C12; OCDD-13C12; Octachlorodibenzo[b,e][1,4]dioxin-13C12
IUPAC Name	1,2,3,4,6,7,8,9-octachlorodibenzo-p-dioxin
Related CAS	3268-87-9 (unlabelled)
Isomeric SMILES	[13C]12=[13C]([13C](=[13C]([13C](=[13C]1Cl)Cl)Cl)Cl)O[13C]3=[13C](O2)[13C](=[13C]([13C](=[13C]3Cl)Cl)Cl)Cl
Canonical SMILES	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI	InChI=1S/C12Cl8O2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1
InChI Key	FOIBFBMSLDGNHL-WCGVKTIYSA-N
Purity	98% by CP; 99% atom 13C