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.beta.-Alanine, N-(trifluoroacetyl)-, butyl ester
SpectraBase Compound ID EdCQgOTAGb9
InChI InChI=1S/C9H14F3NO3/c1-2-3-6-16-7(14)4-5-13-8(15)9(10,11)12/h2-6H2,1H3,(H,13,15)
InChIKey RIMMCQWCUWULOT-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 K9Hg50G7tHK
Name .beta.-Alanine, N-(trifluoroacetyl)-, butyl ester
Alternate Name(s) Butyl 3-[(trifluoroacetyl)amino]propanoate 3-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid butyl ester 3-[(2,2,2-trifluoroacetyl)amino]propionic acid butyl ester Butyl 3-[(2,2,2-trifluoroacetyl)amino]propanoate Butyl 3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate Butyl N-(trifluoroacetyl)-.beta.-alaninate
CAS Registry Number 34961-42-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14F3NO3
InChI InChI=1S/C9H14F3NO3/c1-2-3-6-16-7(14)4-5-13-8(15)9(10,11)12/h2-6H2,1H3,(H,13,15)
InChIKey RIMMCQWCUWULOT-UHFFFAOYSA-N
Molecular Weight 241.210 g/mol
SMILES N(C(C(F)(F)F)=O)CCC(=O)OCCCC
SPLASH splash10-0aor-9800000000-1c500c5f153944fdb501
Source of Spectrum W-0-1-446
Wiley ID 754121