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cis-(-)-(alpha,S,1S,2S)-N-(2-BENZYLCYCLOHEXYL)-alpha-METHYLBENZYLAMINE,HYDROCHLORIDE
SpectraBase Compound ID KLCPkG2badK
InChI InChI=1S/C21H27N.ClH/c1-17(19-12-6-3-7-13-19)22-21-15-9-8-14-20(21)16-18-10-4-2-5-11-18;/h2-7,10-13,17,20-22H,8-9,14-16H2,1H3;1H/t17?,20-,21-;/m0./s1
InChIKey MTAGGJUOORYQFF-YNKQZZSYSA-N
Mol Weight 329.91 g/mol
Molecular Formula C21H28ClN
Exact Mass 329.191028 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A5bbMvpNZ3c
Name cis-(-)-(alpha,S,1S,2S)-N-(2-BENZYLCYCLOHEXYL)-alpha-METHYLBENZYLAMINE,HYDROCHLORIDE
Source of Sample A. W. Frahm and G. Knupp, University of Bonn, Bonn, Germany
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27N HCl
InChI InChI=1S/C21H27N.ClH/c1-17(19-12-6-3-7-13-19)22-21-15-9-8-14-20(21)16-18-10-4-2-5-11-18;/h2-7,10-13,17,20-22H,8-9,14-16H2,1H3;1H/t17?,20-,21-;/m0./s1
InChIKey MTAGGJUOORYQFF-YNKQZZSYSA-N
Melting Point 257-259C
Molecular Weight 329.92
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZYLAMINE, N-/2-BENZYLCYCLOHEXYL/-A-METHYL-, HYDROCHLORIDE, cis- /minus/-/A-S,1S,2S/-,