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2-Bromobenzyl amine-(phenyl-[13C6]) hydrochloride

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General Information
Catalog: BLP-005662
CAS: 1325559-26-9
Molecular Formula: [13C]6CH9BrClN
Molecular Weight: 228.47

Chemical Structure

Description	2-Bromobenzyl amine-(phenyl-[13C6]) hydrochloride is a 13C labelled 2-Bromobenzyl amine hydrochloride. 2-Bromobenzyl amine hydrochloride is a useful building block in many chemical conversions.
IUPAC Name	(6-bromo(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)methanamine;hydrochloride
Related CAS	5465-63-4 (unlabelled)
Isomeric SMILES	[13CH]1=[13CH][13CH]=[13C]([13C](=[13CH]1)CN)Br.Cl
Canonical SMILES	C1=CC=C(C(=C1)CN)Br.Cl
InChI	InChI=1S/C7H8BrN.ClH/c8-7-4-2-1-3-6(7)5-9;/h1-4H,5,9H2;1H/i1+1,2+1,3+1,4+1,6+1,7+1;
InChI Key	MDEJOHXOXKDGOU-BTZXTVEYSA-N
Melting Point	227-230°C
Purity	98% by CP; 99% atom 13C
Appearance	Solid