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ETHYL 3,3-ETHYLENEDIOXY-4,4,4-TRIFLUORO-2-(3-PHENYLPROPYL)BUTANOATE
SpectraBase Compound ID EnV1NBc59D4
InChI InChI=1S/C17H21F3O4/c1-2-22-15(21)14(10-6-9-13-7-4-3-5-8-13)16(17(18,19)20)23-11-12-24-16/h3-5,7-8,14H,2,6,9-12H2,1H3
InChIKey QMLLKMUHWPGXDR-UHFFFAOYSA-N
Mol Weight 346.35 g/mol
Molecular Formula C17H21F3O4
Exact Mass 346.139194 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EdlKkATkrVY
Name ETHYL 3,3-ETHYLENEDIOXY-4,4,4-TRIFLUORO-2-(3-PHENYLPROPYL)BUTANOATE
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Formula C17H21F3O4
InChI InChI=1S/C17H21F3O4/c1-2-22-15(21)14(10-6-9-13-7-4-3-5-8-13)16(17(18,19)20)23-11-12-24-16/h3-5,7-8,14H,2,6,9-12H2,1H3
InChIKey QMLLKMUHWPGXDR-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