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3-(4-CHLOROBENZYL)-2,3-DIFLUORO-2,3-DIHYDROTHIOCHROMAN-4-ONE
SpectraBase Compound ID 6A98kBZAdr4
InChI InChI=1S/C16H11ClF2OS/c17-11-7-5-10(6-8-11)9-16(19)14(20)12-3-1-2-4-13(12)21-15(16)18/h1-8,15H,9H2
InChIKey XCBSBBQXYOZDNR-UHFFFAOYSA-N
Mol Weight 324.77 g/mol
Molecular Formula C16H11ClF2OS
Exact Mass 324.01872 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtzwROPswMg
Name 3-(4-CHLOROBENZYL)-2,3-DIFLUORO-2,3-DIHYDROTHIOCHROMAN-4-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11ClF2OS
InChI InChI=1S/C16H11ClF2OS/c17-11-7-5-10(6-8-11)9-16(19)14(20)12-3-1-2-4-13(12)21-15(16)18/h1-8,15H,9H2
InChIKey XCBSBBQXYOZDNR-UHFFFAOYSA-N
Literature Reference Author K.M.DAWOOD,H.ISHII,T.FUCHIGAMI
Literature Reference Citation J.ORG.CHEM.,66,7030(2001)
Literature Reference DOI 10.1021/jo0104936
Solvent Unknown
Source File Reference UWVN26535