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cis-2-(Diphenylmethyl)-N-[(4-chlorophenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
SpectraBase Compound ID 5iOzfp37PvP
InChI InChI=1S/C27H29ClN2/c28-24-13-11-20(12-14-24)19-29-26-23-15-17-30(18-16-23)27(26)25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,23,25-27,29H,15-19H2/t26-,27-/m1/s1
InChIKey AVOBUSCWJGQAJM-KAYWLYCHSA-N
Mol Weight 417.0 g/mol
Molecular Formula C27H29ClN2
Exact Mass 416.201927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsuYqbz2A1b
Name cis-2-(Diphenylmethyl)-N-[(4-chlorophenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
Alternate Name(s) (2R,3R)-2-benzhydryl-N-(4-chlorobenzyl)-1-azabicyclo[2.2.2]octan-3-amine N-[(2R,3R)-2-benzhydryl-1-azabicyclo[2.2.2]oct-3-yl]-N-(4-chlorobenzyl)amine
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Formula C27H29ClN2
InChI InChI=1S/C27H29ClN2/c28-24-13-11-20(12-14-24)19-29-26-23-15-17-30(18-16-23)27(26)25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,23,25-27,29H,15-19H2/t26-,27-/m1/s1
InChIKey AVOBUSCWJGQAJM-KAYWLYCHSA-N
Molecular Weight 416.996 g/mol
SMILES N([C@]1([C@](N2CCC1CC2)(C(c1ccccc1)c1ccccc1)[H])[H])Cc1ccc(cc1)Cl
SPLASH splash10-002b-6890000000-3f3285cc37d03d113d1a
Source of Spectrum E1-35-2596-7
Wiley ID 1574409