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.beta.-Alanine, N-(trifluoroacetyl)-, 1-methylbutyl ester
SpectraBase Compound ID 3wwhx4iAzUp
InChI InChI=1S/C10H16F3NO3/c1-3-4-7(2)17-8(15)5-6-14-9(16)10(11,12)13/h7H,3-6H2,1-2H3,(H,14,16)
InChIKey LTPUGMJBZFLLDT-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 43zyVobVbPP
Name .beta.-Alanine, N-(trifluoroacetyl)-, 1-methylbutyl ester
CAS Registry Number 57983-45-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16F3NO3
InChI InChI=1S/C10H16F3NO3/c1-3-4-7(2)17-8(15)5-6-14-9(16)10(11,12)13/h7H,3-6H2,1-2H3,(H,14,16)
InChIKey LTPUGMJBZFLLDT-UHFFFAOYSA-N
Molecular Weight 255.237 g/mol
SMILES N(CCC(OC(CCC)C)=O)C(C(F)(F)F)=O
SPLASH splash10-0aou-9300000000-578963ece60826eff6a8
Source of Spectrum W5-22515-0-0
Synonyms 1-Methylbutyl 3-[(trifluoroacetyl)amino]propanoate 1-Methylbutyl 3-[(2,2,2-trifluoroacetyl)amino]propanoate 3-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid pentan-2-yl ester 3-[(2,2,2-trifluoroacetyl)amino]propionic acid 1-methylbutyl ester Pentan-2-yl 3-[(2,2,2-trifluoroacetyl)amino]propanoate Pentan-2-yl 3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate
Wiley ID 1258596