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.beta.-Alanine, N-methyl-N-(trifluoroacetyl)-, 1-methylpropyl ester, (S)-
SpectraBase Compound ID 9eJ8FXYFipF
InChI InChI=1S/C10H16F3NO3/c1-4-7(2)17-8(15)5-6-14(3)9(16)10(11,12)13/h7H,4-6H2,1-3H3
InChIKey MECGQVNRUPNHJT-UHFFFAOYSA-N
Mol Weight 255.24 g/mol
Molecular Formula C10H16F3NO3
Exact Mass 255.108228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Kzxjvitea2
Name .beta.-Alanine, N-methyl-N-(trifluoroacetyl)-, 1-methylpropyl ester, (S)-
CAS Registry Number 54986-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16F3NO3
InChI InChI=1S/C10H16F3NO3/c1-4-7(2)17-8(15)5-6-14(3)9(16)10(11,12)13/h7H,4-6H2,1-3H3
InChIKey MECGQVNRUPNHJT-UHFFFAOYSA-N
Molecular Weight 255.237 g/mol
SMILES C(N(C(C(F)(F)F)=O)C)CC(OC(CC)C)=O
SPLASH splash10-0536-3900000000-902dc81a123287d7fe49
Source of Spectrum AS-0-10-0
Synonyms Sec-butyl 3-[methyl(trifluoroacetyl)amino]propanoate 3-[methyl-(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid butan-2-yl ester 3-[methyl-(2,2,2-trifluoroacetyl)amino]propionic acid sec-butyl ester Butan-2-yl 3-[methyl-(2,2,2-trifluoroacetyl)amino]propanoate Butan-2-yl 3-[methyl-[2,2,2-tris(fluoranyl)ethanoyl]amino]propanoate sec-butyl 3-[methyl-(2,2,2-trifluoroacetyl)amino]propanoate
Wiley ID 36117