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4,4,4-Trifluoro-3-trifluoromethyl-orthocrotonic acid, ethyl ester

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4,4,4-Trifluoro-3-trifluoromethyl-orthocrotonic acid, ethyl ester
SpectraBase Compound ID 7M3XU1AYrCq
InChI InChI=1S/C11H16F6O3/c1-4-18-9(19-5-2,20-6-3)7-8(10(12,13)14)11(15,16)17/h7H,4-6H2,1-3H3
InChIKey ZPWXMIYWFOCYHK-UHFFFAOYSA-N
Mol Weight 310.24 g/mol
Molecular Formula C11H16F6O3
Exact Mass 310.100363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qyfU4uPTnc
Name 4,4,4-Trifluoro-3-trifluoromethyl-orthocrotonic acid, ethyl ester
CAS Registry Number 76790-84-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H16F6O3
InChI InChI=1S/C11H16F6O3/c1-4-18-9(19-5-2,20-6-3)7-8(10(12,13)14)11(15,16)17/h7H,4-6H2,1-3H3
InChIKey ZPWXMIYWFOCYHK-UHFFFAOYSA-N
Literature Reference R.W. Saalfrank, W. Paul, H. Liebenow, Angew. Chem. 92, 740 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3