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L-Isovaline, N-(trifluoroacetyl)-, 1-methylpropyl ester
SpectraBase Compound ID pKdh05BM0F
InChI InChI=1S/C11H18F3NO3/c1-5-7(3)18-9(17)10(4,6-2)15-8(16)11(12,13)14/h7H,5-6H2,1-4H3,(H,15,16)
InChIKey SSZKUJCRYPMGGF-UHFFFAOYSA-N
Mol Weight 269.26 g/mol
Molecular Formula C11H18F3NO3
Exact Mass 269.123878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MuqbWPzwcC
Name L-Isovaline, N-(trifluoroacetyl)-, 1-methylpropyl ester
CAS Registry Number 54889-84-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18F3NO3
InChI InChI=1S/C11H18F3NO3/c1-5-7(3)18-9(17)10(4,6-2)15-8(16)11(12,13)14/h7H,5-6H2,1-4H3,(H,15,16)
InChIKey SSZKUJCRYPMGGF-UHFFFAOYSA-N
Molecular Weight 269.264 g/mol
SMILES N(C(C(OC(CC)C)=O)(CC)C)C(C(F)(F)F)=O
SPLASH splash10-014i-3900000000-906c1e23827eaaf240bf
Source of Spectrum AS-0-15-0
Synonyms D-Isovaline, N-(trifluoroacetyl)-, 1-methylpropyl ester Sec-butyl 2-methyl-2-[(trifluoroacetyl)amino]butanoate 2-Methyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid butan-2-yl ester 2-Methyl-2-[(2,2,2-trifluoroacetyl)amino]butyric acid sec-butyl ester Butan-2-yl 2-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanoate Butan-2-yl 2-methyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoate sec-butyl 2-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanoate
Wiley ID 38902