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N-(4-PENTENOYL)-(2S)-AMINO-4,4,4-TRIFLUOROBUTYRIC-ACID-CYANOMETHYLESTER
SpectraBase Compound ID 2WU3rHdqZpe
InChI InChI=1S/C11H13F3N2O3/c1-2-3-4-9(17)16-8(7-11(12,13)14)10(18)19-6-5-15/h2,8H,1,3-4,6-7H2,(H,16,17)/t8-/m0/s1
InChIKey PQXHTXOKCTZRCL-QMMMGPOBSA-N
Mol Weight 278.23 g/mol
Molecular Formula C11H13F3N2O3
Exact Mass 278.087827 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lt8gDJuC2NX
Name N-(4-PENTENOYL)-(2S)-AMINO-4,4,4-TRIFLUOROBUTYRIC-ACID-CYANOMETHYLESTER
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H13F3N2O3
InChI InChI=1S/C11H13F3N2O3/c1-2-3-4-9(17)16-8(7-11(12,13)14)10(18)19-6-5-15/h2,8H,1,3-4,6-7H2,(H,16,17)/t8-/m0/s1
InChIKey PQXHTXOKCTZRCL-QMMMGPOBSA-N
Literature Reference Author S.YE,A.A.BERGER,D.PETZOLD,O.REIMANN,B.MATT,B.KOKSCH
Literature Reference Citation BEIL.J.ORG.CHEM.,6,40,1(2010)
Solvent CDCl3
Source File Reference UWBT10011