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5-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-PENTANE-1,5-DIOL
SpectraBase Compound ID 3Gq56z0PVkP
InChI InChI=1S/C17H26O2S/c18-14-8-5-11-16(19)17(12-6-2-7-13-17)20-15-9-3-1-4-10-15/h1,3-4,9-10,16,18-19H,2,5-8,11-14H2
InChIKey AGLMWAFZIAAEJM-UHFFFAOYSA-N
Mol Weight 294.45 g/mol
Molecular Formula C17H26O2S
Exact Mass 294.165351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5etkXZC3xI
Name 5-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-PENTANE-1,5-DIOL
Compound Number 8,N=4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H26O2S
InChI InChI=1S/C17H26O2S/c18-14-8-5-11-16(19)17(12-6-2-7-13-17)20-15-9-3-1-4-10-15/h1,3-4,9-10,16,18-19H,2,5-8,11-14H2
InChIKey AGLMWAFZIAAEJM-UHFFFAOYSA-N
Literature Reference Author L.DJAKOVITCH,J.EAMES,D.J.FOX,F.H.SANSBURY,S.WARREN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2771(1999)
Literature Reference DOI 10.1039/a905498g
Molecular Weight 294.452 g/mol
Solvent CDCl3
Source File Reference UWRU8927