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(E)-METHYL-3-[4-(TRIFLUOROMETHOXY)-PHENYL]-PROP-2-ENOATE
SpectraBase Compound ID 4A2RfdOfu0y
InChI InChI=1S/C11H9F3O3/c1-16-10(15)7-4-8-2-5-9(6-3-8)17-11(12,13)14/h2-7H,1H3/b7-4+
InChIKey MIVYMUINRMQQIT-QPJJXVBHSA-N
Mol Weight 246.19 g/mol
Molecular Formula C11H9F3O3
Exact Mass 246.050379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ePuqLYC8yS
Name (E)-METHYL-3-[4-(TRIFLUOROMETHOXY)-PHENYL]-PROP-2-ENOATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9F3O3
InChI InChI=1S/C11H9F3O3/c1-16-10(15)7-4-8-2-5-9(6-3-8)17-11(12,13)14/h2-7H,1H3/b7-4+
InChIKey MIVYMUINRMQQIT-QPJJXVBHSA-N
Literature Reference Author P.DE,G.K.YOYA,P.CONSTANT,F.BEDOS-BELVAL,H.DURAN,N.SAFFON,M.D AFFE,M.BALTAS
Literature Reference Citation J.MED.CHEM.,54,1449(2011)
Literature Reference DOI 10.1021/jm101510d
Molecular Weight 246.186 g/mol
Solvent CDCl3
Source File Reference UWMZ48130