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(2S,1'R,5'R)-(+)-2-(2'-AZABICYCLO-[3.3.0]-OCTAN-2'-YL)-1,1,2-TRIPHENYLETHANOL
SpectraBase Compound ID F4kOPh4kLny
InChI InChI=1S/C27H29NO/c29-27(23-14-6-2-7-15-23,24-16-8-3-9-17-24)26(22-11-4-1-5-12-22)28-20-19-21-13-10-18-25(21)28/h1-9,11-12,14-17,21,25-26,29H,10,13,18-20H2/t21-,25-,26+/m1/s1
InChIKey USECBZOHJFHXEL-QGDZQMKYSA-N
Mol Weight 383.54 g/mol
Molecular Formula C27H29NO
Exact Mass 383.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G8M0I9aV3QM
Name (2S,1'R,5'R)-(+)-2-(2'-AZABICYCLO-[3.3.0]-OCTAN-2'-YL)-1,1,2-TRIPHENYLETHANOL
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H29NO
InChI InChI=1S/C27H29NO/c29-27(23-14-6-2-7-15-23,24-16-8-3-9-17-24)26(22-11-4-1-5-12-22)28-20-19-21-13-10-18-25(21)28/h1-9,11-12,14-17,21,25-26,29H,10,13,18-20H2/t21-,25-,26+/m1/s1
InChIKey USECBZOHJFHXEL-QGDZQMKYSA-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 383.533 g/mol
Solvent CDCl3
Source File Reference UWGE3866