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7-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-HEPTANE-1,7-DIOL
SpectraBase Compound ID Duji3NaV9PB
InChI InChI=1S/C19H30O2S/c20-16-10-2-1-7-13-18(21)19(14-8-4-9-15-19)22-17-11-5-3-6-12-17/h3,5-6,11-12,18,20-21H,1-2,4,7-10,13-16H2
InChIKey NWCKDKQYVLSPLD-UHFFFAOYSA-N
Mol Weight 322.51 g/mol
Molecular Formula C19H30O2S
Exact Mass 322.196651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LKnhdTNba3R
Name 7-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-HEPTANE-1,7-DIOL
Compound Number 8,N=6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O2S
InChI InChI=1S/C19H30O2S/c20-16-10-2-1-7-13-18(21)19(14-8-4-9-15-19)22-17-11-5-3-6-12-17/h3,5-6,11-12,18,20-21H,1-2,4,7-10,13-16H2
InChIKey NWCKDKQYVLSPLD-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 322.506 g/mol
Solvent CDCl3
Source File Reference UWRU8929