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.beta.-Alanine, N-(trifluoroacetyl)-, 1-methylpropyl ester
SpectraBase Compound ID GMaV82UK8bJ
InChI InChI=1S/C9H14F3NO3/c1-3-6(2)16-7(14)4-5-13-8(15)9(10,11)12/h6H,3-5H2,1-2H3,(H,13,15)
InChIKey RBYHMABTIWHOOD-UHFFFAOYSA-N
Mol Weight 241.21 g/mol
Molecular Formula C9H14F3NO3
Exact Mass 241.092578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGcm6do43vM
Name .beta.-Alanine, N-(trifluoroacetyl)-, 1-methylpropyl ester
CAS Registry Number 55133-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14F3NO3
InChI InChI=1S/C9H14F3NO3/c1-3-6(2)16-7(14)4-5-13-8(15)9(10,11)12/h6H,3-5H2,1-2H3,(H,13,15)
InChIKey RBYHMABTIWHOOD-UHFFFAOYSA-N
Molecular Weight 241.210 g/mol
SMILES N(CCC(OC(CC)C)=O)C(C(F)(F)F)=O
SPLASH splash10-066r-7900000000-20e8308cc6c012a4fc4c
Source of Spectrum AS-0-4-0
Synonyms .beta.-Alanine, N-(trifluoroacetyl)-, 1-methylpropyl ester, (S)- Sec-butyl 3-[(trifluoroacetyl)amino]propanoate 3-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid butan-2-yl ester 3-[(2,2,2-trifluoroacetyl)amino]propionic acid sec-butyl ester Butan-2-yl 3-[(2,2,2-trifluoroacetyl)amino]propanoate Butan-2-yl 3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate sec-butyl 3-[(2,2,2-trifluoroacetyl)amino]propanoate
Wiley ID 33199