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(2R,S(S))-2-[(1R)-1-(4-FLUOROPHENYL)-1-HYDROXYETHYL]-1,3-BEZOXATHIOL-3-(2H)-OXIDE
SpectraBase Compound ID E4Jgn1IJkcl
InChI InChI=1S/C15H13FO3S/c1-15(17,10-6-8-11(16)9-7-10)14-19-12-4-2-3-5-13(12)20(14)18/h2-9,14,17H,1H3/t14-,15-,20?/m1/s1
InChIKey YXCNFGKZLOFCMQ-YNCRUDOASA-N
Mol Weight 292.32 g/mol
Molecular Formula C15H13FO3S
Exact Mass 292.056944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LdKRFvmcL7Q
Name (2R,S(S))-2-[(1R)-1-(4-FLUOROPHENYL)-1-HYDROXYETHYL]-1,3-BEZOXATHIOL-3-(2H)-OXIDE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13FO3S
InChI InChI=1S/C15H13FO3S/c1-15(17,10-6-8-11(16)9-7-10)14-19-12-4-2-3-5-13(12)20(14)18/h2-9,14,17H,1H3/t14-,15-,20?/m1/s1
InChIKey YXCNFGKZLOFCMQ-YNCRUDOASA-N
Literature Reference Author S.CABIDDU,E.CADONI,S.MELIS,A.IANNI,A.M.BERNARD,M.G.CABIDDU,S .D.MONTIS,C.FATTUONI
Literature Reference Citation J.HETCYCL.CHEM.,40,979(2003)
Literature Reference DOI 10.1002/jhet.5570400605
Molecular Weight 292.325 g/mol
Solvent DMSO-D6
Source File Reference UWMS22901