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O-BENZYL-L-THREONINE-TRIFLUOROACETIC-ACID-SALT

View entire compound with spectra: 1 NMR

O-BENZYL-L-THREONINE-TRIFLUOROACETIC-ACID-SALT
SpectraBase Compound ID IB8FsQal7Xc
InChI InChI=1S/C11H15NO3.C2HF3O2/c1-8(10(12)11(13)14)15-7-9-5-3-2-4-6-9;3-2(4,5)1(6)7/h2-6,8,10H,7,12H2,1H3,(H,13,14);(H,6,7)/t8?,10-;/m1./s1
InChIKey CXKMLYRQGPHQCZ-JDXSOMNQSA-N
Mol Weight 323.27 g/mol
Molecular Formula C13H16F3NO5
Exact Mass 323.098057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Hxuhed2Uh5
Name O-BENZYL-L-THREONINE-TRIFLUOROACETIC-ACID-SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16F3NO5
InChI InChI=1S/C11H15NO3.C2HF3O2/c1-8(10(12)11(13)14)15-7-9-5-3-2-4-6-9;3-2(4,5)1(6)7/h2-6,8,10H,7,12H2,1H3,(H,13,14);(H,6,7)/t8?,10-;/m1./s1
InChIKey CXKMLYRQGPHQCZ-JDXSOMNQSA-N
Literature Reference Author A.ALBECK,S.FLUSS,R.PERSKY
Literature Reference Citation J.AM.CHEM.SOC.,118,3591(1996)
Literature Reference DOI 10.1021/ja954261y
Molecular Weight 323.269 g/mol
Sample ID 37607
Solvent CDCl3