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BENZYL-5-ACETOXYMETHYL-4-(1-ACETOXY-2,2,2-TRIFLUOROETHYL)-3-METHYLPYRROLE-2-CARBOXYLATE
SpectraBase Compound ID 4UeCeYIlHgt
InChI InChI=1S/C20H20F3NO6/c1-11-16(18(20(21,22)23)30-13(3)26)15(10-28-12(2)25)24-17(11)19(27)29-9-14-7-5-4-6-8-14/h4-8,18,24H,9-10H2,1-3H3
InChIKey DLVLETPAATXZCG-UHFFFAOYSA-N
Mol Weight 427.38 g/mol
Molecular Formula C20H20F3NO6
Exact Mass 427.124272 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HfXiZMMANdk
Name BENZYL-5-ACETOXYMETHYL-4-(1-ACETOXY-2,2,2-TRIFLUOROETHYL)-3-METHYLPYRROLE-2-CARBOXYLATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20F3NO6
InChI InChI=1S/C20H20F3NO6/c1-11-16(18(20(21,22)23)30-13(3)26)15(10-28-12(2)25)24-17(11)19(27)29-9-14-7-5-4-6-8-14/h4-8,18,24H,9-10H2,1-3H3
InChIKey DLVLETPAATXZCG-UHFFFAOYSA-N
Literature Reference Author C.S.BESHARA,B.M.PEARCE,A.THOMPSON
Literature Reference Citation CAN.J.CHEM.,86,951(2008)
Literature Reference DOI 10.1139/v08-101
Solvent CDCl3
Source File Reference UWMZ46075