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(R)-N-[4'-(2,2,2-TRIFLUOROACETAMIDO)]-BENZYL_2-ACETAMIDO-3-METHOXYPROPIONAMIDE
SpectraBase Compound ID LAgqoh1LZce
InChI InChI=1S/C15H18F3N3O4/c1-9(22)20-12(8-25-2)13(23)19-7-10-3-5-11(6-4-10)21-14(24)15(16,17)18/h3-6,12H,7-8H2,1-2H3,(H,19,23)(H,20,22)(H,21,24)/t12-/m1/s1
InChIKey YJGGQBLCCIQNLM-GFCCVEGCSA-N
Mol Weight 361.32 g/mol
Molecular Formula C15H18F3N3O4
Exact Mass 361.124941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FL6xXtRupGs
Name (R)-N-[4'-(2,2,2-TRIFLUOROACETAMIDO)]-BENZYL_2-ACETAMIDO-3-METHOXYPROPIONAMIDE
Compound Number (R)-33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18F3N3O4
InChI InChI=1S/C15H18F3N3O4/c1-9(22)20-12(8-25-2)13(23)19-7-10-3-5-11(6-4-10)21-14(24)15(16,17)18/h3-6,12H,7-8H2,1-2H3,(H,19,23)(H,20,22)(H,21,24)/t12-/m1/s1
InChIKey YJGGQBLCCIQNLM-GFCCVEGCSA-N
Literature Reference Author C.SALOME,E.SALOME-GROSJEAN,K.D.PARK,P.MORIEUX,R.SWENDIMAN,E. DEMARCO,J.P.STABLES,
Literature Reference Citation J.MED.CHEM.,53,1288(2010)
Literature Reference DOI 10.1021/jm901563p
Molecular Weight 361.321 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46687