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N-Benzyl-7.beta.-(6'-chloro-3'-pyridyl)-9-azabicyclo[4.2.1]nonane
SpectraBase Compound ID C8WxUJQcts
InChI InChI=1S/C20H23ClN2/c21-20-11-10-16(13-22-20)18-12-17-8-4-5-9-19(18)23(17)14-15-6-2-1-3-7-15/h1-3,6-7,10-11,13,17-19H,4-5,8-9,12,14H2/t17-,18+,19-/m0/s1
InChIKey FJDLTTLPITWQLX-OTWHNJEPSA-N
Mol Weight 326.87 g/mol
Molecular Formula C20H23ClN2
Exact Mass 326.154976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4e6biqh1DEP
Name N-Benzyl-7.beta.-(6'-chloro-3'-pyridyl)-9-azabicyclo[4.2.1]nonane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23ClN2
InChI InChI=1S/C20H23ClN2/c21-20-11-10-16(13-22-20)18-12-17-8-4-5-9-19(18)23(17)14-15-6-2-1-3-7-15/h1-3,6-7,10-11,13,17-19H,4-5,8-9,12,14H2/t17-,18+,19-/m0/s1
InChIKey FJDLTTLPITWQLX-OTWHNJEPSA-N
Molecular Weight 326.871 g/mol
SMILES [C@@]12(N([C@](C[C@@]2(c2cnc(cc2)Cl)[H])(CCCC1)[H])Cc1ccccc1)[H]
SPLASH splash10-002f-9235000000-54c15db390f09e13744c
Source of Spectrum K-2001-1049-20
Synonyms (6R,7R)-9-benzyl-7-(6-chloro-3-pyridinyl)-9-azabicyclo[4.2.1]nonane
Wiley ID 1578869