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6-Fluoro-isothiochroman

View entire compound with spectra: 4 NMR

6-Fluoro-isothiochroman
SpectraBase Compound ID HiikDTaAuGn
InChI InChI=1S/C9H9FS/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-2,5H,3-4,6H2
InChIKey YGTYAMDFDUHTEN-UHFFFAOYSA-N
Mol Weight 168.23 g/mol
Molecular Formula C9H9FS
Exact Mass 168.0409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KPtRY6o9Cy
Name 6-FLUOROISOTHIOCHROMAN
CAS Registry Number 50396-75-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9FS
InChI InChI=1S/C9H9FS/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-2,5H,3-4,6H2
InChIKey YGTYAMDFDUHTEN-UHFFFAOYSA-N
Literature Reference Author W.ADCOCK,B.D.GUPTA,W.KITCHING
Literature Reference Citation J.ORG.CHEM.,41,1498(1976)
Literature Reference DOI 10.1021/jo00871a003
Molecular Weight 168.229 g/mol
Solvent CDCl3
Source File Reference UNIW12098