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METHYL-6-PHENYL-2-FLUOROHEXANOATE
SpectraBase Compound ID 1AUrCsk7AfK
InChI InChI=1S/C13H17FO2/c1-16-13(15)12(14)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8,12H,5-6,9-10H2,1H3
InChIKey PULPZQLLCBQJCZ-UHFFFAOYSA-N
Mol Weight 224.28 g/mol
Molecular Formula C13H17FO2
Exact Mass 224.121258 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vla0yBkUgQ
Name METHYL-6-PHENYL-2-FLUOROHEXANOATE
Compound Number 17B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17FO2
InChI InChI=1S/C13H17FO2/c1-16-13(15)12(14)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8,12H,5-6,9-10H2,1H3
InChIKey PULPZQLLCBQJCZ-UHFFFAOYSA-N
Literature Reference Author G.KOKOTOS,Y.H.HSU,J.E.BURKE,C.BASKAKIS,C.G.KOKOTOS,V.MAGRIOT I,E.A.DENNIS
Literature Reference Citation J.MED.CHEM.,53,3602(2010)
Literature Reference DOI 10.1021/jm901872v
Solvent CDCl3
Source File Reference UWMZ46015