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ANTI-9,14-DIFLUORO-2,11-DITHIO-[3.3]-METAPARACYClOPHANE
SpectraBase Compound ID 31oCFCk3oha
InChI InChI=1S/C16H14F2S2/c17-15-6-11-4-5-12(15)8-20-10-14-3-1-2-13(16(14)18)9-19-7-11/h1-6H,7-10H2
InChIKey FKUNACGINDHHCM-UHFFFAOYSA-N
Mol Weight 308.4 g/mol
Molecular Formula C16H14F2S2
Exact Mass 308.050499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9ccTnA3ICF
Name ANTI-9,14-DIFLUORO-2,11-DITHIO-[3.3]-METAPARACYClOPHANE
Compound Number 3F2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14F2S2
InChI InChI=1S/C16H14F2S2/c17-15-6-11-4-5-12(15)8-20-10-14-3-1-2-13(16(14)18)9-19-7-11/h1-6H,7-10H2
InChIKey FKUNACGINDHHCM-UHFFFAOYSA-N
Literature Reference Author L.ERNST,K.IBROM
Literature Reference Citation MAGN.RES.CHEM.,36,S71(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199806)36:133.3.co;2-m
Molecular Weight 308.404 g/mol
Solvent CDCl3
Source File Reference UWCS24916