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3-FLUORO-1,5-BENZODITHIEPINE;KONFORMER-(CA)

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3-FLUORO-1,5-BENZODITHIEPINE;KONFORMER-(CA)
SpectraBase Compound ID B0ew4gjdcQH
InChI InChI=1S/C9H9FS2/c10-7-5-11-8-3-1-2-4-9(8)12-6-7/h1-4,7H,5-6H2
InChIKey MSAIWOYYBFWKTB-UHFFFAOYSA-N
Mol Weight 200.29 g/mol
Molecular Formula C9H9FS2
Exact Mass 200.012971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2S2m3UqQzy0
Name 3-FLUORO-1,5-BENZODITHIEPINE;KONFORMER-(CA)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9FS2
InChI InChI=1S/C9H9FS2/c10-7-5-11-8-3-1-2-4-9(8)12-6-7/h1-4,7H,5-6H2
InChIKey MSAIWOYYBFWKTB-UHFFFAOYSA-N
Literature Reference Author P.DIONNE,M.ST-JACQUES
Literature Reference Citation CAN.J.CHEM.,68,513(1990)
Literature Reference DOI 10.1139/v90-079
Molecular Weight 200.289 g/mol
Solvent CHClF2
Source File Reference UWED9620