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(1R,2S,7S,8R)-3,5-DIAZA-2,7-DIMETHYL-1,8-DIPHENYLOCTAN-1,8-DIOL-BIS-HYDROCHLORIDE
SpectraBase Compound ID HEXyoKswOEz
InChI InChI=1S/C20H28N2O2.2ClH/c1-15(19(23)17-9-5-3-6-10-17)21-13-14-22-16(2)20(24)18-11-7-4-8-12-18;;/h3-12,15-16,19-24H,13-14H2,1-2H3;2*1H/t15-,16+,19-,20+;;
InChIKey OMLOCWSFZPQJJI-WRXDATGUSA-N
Mol Weight 401.38 g/mol
Molecular Formula C20H30Cl2N2O2
Exact Mass 400.168434 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4OnFYo4E3LY
Name (1R,2S,7S,8R)-3,5-DIAZA-2,7-DIMETHYL-1,8-DIPHENYLOCTAN-1,8-DIOL-BIS-HYDROCHLORIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30Cl2N2O2
InChI InChI=1S/C20H28N2O2.2ClH/c1-15(19(23)17-9-5-3-6-10-17)21-13-14-22-16(2)20(24)18-11-7-4-8-12-18;;/h3-12,15-16,19-24H,13-14H2,1-2H3;2*1H/t15-,16+,19-,20+;;
InChIKey OMLOCWSFZPQJJI-WRXDATGUSA-N
Literature Reference Author P.J.MURPHY,S.PINATO,D.THOMAS,J.L.OLLER-LOPEZ
Literature Reference Citation CHEM.PHARM.BULL.,54,1331(2006)
Literature Reference DOI 10.1248/cpb.54.1331
Molecular Weight 401.376 g/mol
Sample ID 637292
Solvent CD3OD