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L-Isoleucine, N-(trifluoroacetyl)-, butyl ester
SpectraBase Compound ID 2KNdwSn8SSR
InChI InChI=1S/C12H20F3NO3/c1-4-6-7-19-10(17)9(8(3)5-2)16-11(18)12(13,14)15/h8-9H,4-7H2,1-3H3,(H,16,18)
InChIKey RXCCQFOMEQOSMR-UHFFFAOYSA-N
Mol Weight 283.29 g/mol
Molecular Formula C12H20F3NO3
Exact Mass 283.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPOX5s4JsBj
Name L-Isoleucine, N-(trifluoroacetyl)-, butyl ester
CAS Registry Number 2505-28-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20F3NO3
InChI InChI=1S/C12H20F3NO3/c1-4-6-7-19-10(17)9(8(3)5-2)16-11(18)12(13,14)15/h8-9H,4-7H2,1-3H3,(H,16,18)
InChIKey RXCCQFOMEQOSMR-UHFFFAOYSA-N
Molecular Weight 283.291 g/mol
SMILES N(C(C(OCCCC)=O)C(CC)C)C(C(F)(F)F)=O
SPLASH splash10-067i-8900000000-fd07f929cc89e93585f5
Source of Spectrum KO-2-12-1
Synonyms 3-Methyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanoic acid butyl ester Butyl 3-methyl-2-[(trifluoroacetyl)amino]pentanoate 3-Methyl-2-[(2,2,2-trifluoroacetyl)amino]valeric acid butyl ester Butyl 3-methyl-2-[(2,2,2-trifluoroacetyl)amino]pentanoate Butyl 3-methyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate Ile, butyl ester, TFA Isoleucine, N-(trifluoroacetyl)-, butyl ester, L
Wiley ID 1286723