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N-trifluoroacetylvaline

View entire compound with spectra: 1 MS (GC)

N-trifluoroacetylvaline
SpectraBase Compound ID AAaa0eHxpeI
InChI InChI=1S/C7H10F3NO3/c1-3(2)4(5(12)13)11-6(14)7(8,9)10/h3-4H,1-2H3,(H,11,14)(H,12,13)/t4-/m0/s1
InChIKey XZNJCFYYNFONPC-BYPYZUCNSA-N
Mol Weight 213.16 g/mol
Molecular Formula C7H10F3NO3
Exact Mass 213.061278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJkPiIgh7oJ
Name N-trifluoroacetylvaline
Alternate Name(s) (2S)-3-methyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid (2S)-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid (2S)-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butyric acid (2S)-3-methyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoic acid
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Formula C7H10F3NO3
InChI InChI=1S/C7H10F3NO3/c1-3(2)4(5(12)13)11-6(14)7(8,9)10/h3-4H,1-2H3,(H,11,14)(H,12,13)/t4-/m0/s1
InChIKey XZNJCFYYNFONPC-BYPYZUCNSA-N
Molecular Weight 213.156 g/mol
SMILES N(C(C(F)(F)F)=O)[C@](C(=O)O)(C(C)C)[H]
SPLASH splash10-0kvo-9400000000-f08a04d61064b8e895f5
Source of Spectrum KQ-6-552-75
Wiley ID 1212323