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ERYTHRO-[ETHYL 2-HYDROXY-3-(4-CHLOROPHENYL)-3-FLUOROPROPANOATE]
SpectraBase Compound ID DPy2Kk1lnBJ
InChI InChI=1S/C11H12ClFO3/c1-2-16-11(15)10(14)9(13)7-3-5-8(12)6-4-7/h3-6,9-10,14H,2H2,1H3/t9-,10-/m1/s1
InChIKey RKKLUTUZILTKDJ-NXEZZACHSA-N
Mol Weight 246.67 g/mol
Molecular Formula C11H12ClFO3
Exact Mass 246.0459 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4t7pcWnHlsc
Name ERYTHRO-[ETHYL 2-HYDROXY-3-(4-CHLOROPHENYL)-3-FLUOROPROPANOATE]
Comments SCALE INVERTED, STEREODESCRIPTORS ARE RELATIVE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12ClFO3
InChI InChI=1S/C11H12ClFO3/c1-2-16-11(15)10(14)9(13)7-3-5-8(12)6-4-7/h3-6,9-10,14H,2H2,1H3/t9-,10-/m1/s1
InChIKey RKKLUTUZILTKDJ-NXEZZACHSA-N
Instrument Name Bruker HX-90
Literature Reference A.I.AYI, M.REMLI, R.CONDOM, R.GUEDJ (1981) J.Fluor.Chem.: v.17, N6, 565-580.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d