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(2S)-2-Amino-6-[(trifluoroacetyl)amino]hexanoic acid, N-acetyl-

View entire compound with spectra: 1 NMR

(2S)-2-Amino-6-[(trifluoroacetyl)amino]hexanoic acid, N-acetyl-
SpectraBase Compound ID BNq0PlNgqn2
InChI InChI=1S/C10H15F3N2O4/c1-6(16)15-7(8(17)18)4-2-3-5-14-9(19)10(11,12)13/h7H,2-5H2,1H3,(H,14,19)(H,15,16)(H,17,18)/t7-/m0/s1
InChIKey RSPYKGURKHYXND-ZETCQYMHSA-N
Mol Weight 284.24 g/mol
Molecular Formula C10H15F3N2O4
Exact Mass 284.098391 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABV7auEfRwX
Name (2S)-2-Amino-6-[(trifluoroacetyl)amino]hexanoic acid, N-acetyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.098391456 u
Formula C10H15F3N2O4
InChI InChI=1S/C10H15F3N2O4/c1-6(16)15-7(8(17)18)4-2-3-5-14-9(19)10(11,12)13/h7H,2-5H2,1H3,(H,14,19)(H,15,16)(H,17,18)/t7-/m0/s1
InChIKey RSPYKGURKHYXND-ZETCQYMHSA-N
Molecular Weight 284.235 g/mol
SMILES C(F)(F)(F)C(=O)NCCCC[C@]([H])(NC(=O)C)C(=O)O