Molecular Structure of N-Benzyl-1,2,3,6-tetrahydropyridine hydrochloride (CAS No. 80477-52-7):
Name: N-Benzyl-1,2,3,6-tetrahydropyridine hydrochloride
Synonyms: 1-Benzyl-1,2,3,6-tetrahydropyridine hydrochloride
Molecular Formula: C12H15N.HCl
Molecular Weight: 209.72
CAS Registry Number: 80477-52-7
Structure Descriptors of N-Benzyl-1,2,3,6-tetrahydropyridine hydrochloride (CAS No. 80477-52-7):
Systematic Name: pyridine, 1,2,3,6-tetrahydro-1-(phenylmethyl)-, hydrochloride (1:1)
SMILES: c1ccc(cc1)CN2CCC=CC2.Cl
InChI: InChI=1/C12H15N.ClH/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;/h1-5,7-8H,6,9-11H2;1H
InChIKey: MSPRMRIWFKXCNH-UHFFFAOYAG
Std. InChI: InChI=1S/C12H15N.ClH/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;/h1-5,7-8H,6,9-11H2;1H
Std. InChIKey: MSPRMRIWFKXCNH-UHFFFAOYSA-N
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