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N-Desmethylsertraline-[13C6] hydrochloride

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General Information
Catalog: BLP-001371
Molecular Formula: C10[13C]6H16Cl3N
Molecular Weight: 334.62

Chemical Structure

Description	N-Desmethylsertraline-[13C6] hydrochloride is a labelled hydrochloride form of N-Desmethylsertraline. N-Desmethylsertraline hydrochloride is a metabolite of Sertraline.
Synonyms	Norsertraline-13C6 hydrochloride salt
IUPAC Name	4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
Related CAS	675126-10-0 (unlabelled)
Canonical SMILES	C1CC(C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl)N.Cl
InChI	InChI=1S/C16H15Cl2N.ClH/c17-14-7-5-10(9-15(14)18)11-6-8-16(19)13-4-2-1-3-12(11)13;/h1-5,7,9,11,16H,6,8,19H2;1H/i1+1,2+1,3+1,4+1,12+1,13+1;
InChI Key	YKXHIERZIRLOLD-JQQCCREHSA-N
Purity	98%; 99% atom 13C
Solubility	Soluble in Methanol or Water
Appearance	Off-white to white solid