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(1S,1'R,5'R)-2-(2'-AZABICYCLO-[3.3.0]-OCTAN-2'-YL)-1-PHENYLETHANETHIOL
SpectraBase Compound ID 3g9YmyPHmTF
InChI InChI=1S/C15H21NS/c17-15(13-5-2-1-3-6-13)11-16-10-9-12-7-4-8-14(12)16/h1-3,5-6,12,14-15,17H,4,7-11H2/t12-,14-,15-/m1/s1
InChIKey HLKDUGNJYOJPMO-BPLDGKMQSA-N
Mol Weight 247.4 g/mol
Molecular Formula C15H21NS
Exact Mass 247.139471 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UQii3ChJ4o
Name (1S,1'R,5'R)-2-(2'-AZABICYCLO-[3.3.0]-OCTAN-2'-YL)-1-PHENYLETHANETHIOL
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21NS
InChI InChI=1S/C15H21NS/c17-15(13-5-2-1-3-6-13)11-16-10-9-12-7-4-8-14(12)16/h1-3,5-6,12,14-15,17H,4,7-11H2/t12-,14-,15-/m1/s1
InChIKey HLKDUGNJYOJPMO-BPLDGKMQSA-N
Literature Reference Author M.KOSSENJANS,M.SOEBERDT,S.WALLBAUM,K.HARMS,J.MARTENS,H.G.AUR ICH
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2353(1999)
Literature Reference DOI 10.1039/a902362c
Molecular Weight 247.398 g/mol
Solvent CDCl3
Source File Reference UWGE3888