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ETHYL 2-(5-PHENYLHEX-5-ENYL)TRIFLUOROACETYLACETATE, HYDRATE
SpectraBase Compound ID K9LvdmryLau
InChI InChI=1S/C18H23F3O4/c1-3-25-16(22)15(17(23,24)18(19,20)21)12-8-7-9-13(2)14-10-5-4-6-11-14/h4-6,10-11,15,23-24H,2-3,7-9,12H2,1H3
InChIKey PJQZTBUKYSSRNI-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C18H23F3O4
Exact Mass 360.154844 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYIUw6AEtjY
Name ETHYL 2-(5-PHENYLHEX-5-ENYL)TRIFLUOROACETYLACETATE, HYDRATE
Comments MIXTURE WITH ANHYDROUS FORM.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H23F3O4
InChI InChI=1S/C18H23F3O4/c1-3-25-16(22)15(17(23,24)18(19,20)21)12-8-7-9-13(2)14-10-5-4-6-11-14/h4-6,10-11,15,23-24H,2-3,7-9,12H2,1H3
InChIKey PJQZTBUKYSSRNI-UHFFFAOYSA-N
Instrument Name Varian EM-360
Literature Reference CORINNE AUBERT, JEAN-PIERRE BEGUE, MICHELIN CHARPENTIER-MORIZE, GERARD NEE,BERNARD LANGLOIS (1989) J.Fluor.Chem.: v.44, N3, 377-394.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d