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(3R*,4R*)-3-ETHYL-3-METHYL-2-(4-METHYLPHENYLSULFINYL)-NONE-4-OL
SpectraBase Compound ID JiuBuShY2H6
InChI InChI=1S/C19H30O2S/c1-6-8-9-10-18(20)19(5,7-2)16(4)22(21)17-13-11-15(3)12-14-17/h11-14,18,20H,4,6-10H2,1-3,5H3/t18-,19?,22?/m0/s1
InChIKey GNJHVMOXKNOMKI-PGFLUOATSA-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 33uHnyhsNIW
Name (3R*,4R*)-3-ETHYL-3-METHYL-2-(4-METHYLPHENYLSULFINYL)-NONE-4-OL
Compound Number 7F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O2S
InChI InChI=1S/C19H30O2S/c1-6-8-9-10-18(20)19(5,7-2)16(4)22(21)17-13-11-15(3)12-14-17/h11-14,18,20H,4,6-10H2,1-3,5H3/t18-,19?,22?/m0/s1
InChIKey GNJHVMOXKNOMKI-PGFLUOATSA-N
Literature Reference Author G.SKLUTE,D.AMSALLEM,A.SHABLI,J.P.VARGHESE,I.MAREK
Literature Reference Citation J.AM.CHEM.SOC.,125,11776(2003)
Literature Reference DOI 10.1021/ja036872t
Molecular Weight 322.506 g/mol
Sample ID 50587
Solvent CDCl3