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3,3,3-TRIFLUOROALANYLPHENYLALANINE-ETHYLESTER-HYDROCHLORIC-ACID-SALT
SpectraBase Compound ID 2fJtJcUwkpz
InChI InChI=1S/C14H17F3N2O3.ClH/c1-2-22-13(21)10(8-9-6-4-3-5-7-9)19-12(20)11(18)14(15,16)17;/h3-7,10-11H,2,8,18H2,1H3,(H,19,20);1H/t10-,11+;/m0./s1
InChIKey VRDAAFBQQYJPFA-VZXYPILPSA-N
Mol Weight 354.76 g/mol
Molecular Formula C14H18ClF3N2O3
Exact Mass 354.095805 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5olQyEx3Oso
Name 3,3,3-TRIFLUOROALANYLPHENYLALANINE-ETHYLESTER-HYDROCHLORIC-ACID-SALT
Compound Number 17CA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18ClF3N2O3
InChI InChI=1S/C14H17F3N2O3.ClH/c1-2-22-13(21)10(8-9-6-4-3-5-7-9)19-12(20)11(18)14(15,16)17;/h3-7,10-11H,2,8,18H2,1H3,(H,19,20);1H/t10-,11+;/m0./s1
InChIKey VRDAAFBQQYJPFA-VZXYPILPSA-N
Literature Reference Author Y.GUO,K.FUJIWARA,K.UNEYAMA
Literature Reference Citation ORG.LETTERS,8,827(2006)
Literature Reference DOI 10.1021/ol0526726
Solvent CDCl3
Source File Reference UWSI40315