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2-FLUORO-5-PHENYL-CYCLOHEPTAN-1,3-DIONE;MAJOR-ISOMER
SpectraBase Compound ID 66ly84hbyLy
InChI InChI=1S/C13H13FO2/c14-13-11(15)7-6-10(8-12(13)16)9-4-2-1-3-5-9/h1-5,10,13H,6-8H2
InChIKey IPAKRJDDIWLIDR-UHFFFAOYSA-N
Mol Weight 220.24 g/mol
Molecular Formula C13H13FO2
Exact Mass 220.089958 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8DTMcQ09fDI
Name 2-FLUORO-5-PHENYL-CYCLOHEPTAN-1,3-DIONE;MINOR-ISOMER
Compound Number 8HK
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13FO2
InChI InChI=1S/C13H13FO2/c14-13-11(15)7-6-10(8-12(13)16)9-4-2-1-3-5-9/h1-5,10,13H,6-8H2
InChIKey IPAKRJDDIWLIDR-UHFFFAOYSA-N
Literature Reference Author D.SALEUR,J.P.BUILLON,C.PORTELLA
Literature Reference Citation J.ORG.CHEM.,66,4543(2001)
Literature Reference DOI 10.1021/jo0017077
Solvent Unknown
Source File Reference UWMS28066