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4-Hydroxy-3-(2',2',2'-trifluoroacetylamino)butanoic acid - Benzyl ester
SpectraBase Compound ID ITRba0EotWU
InChI InChI=1S/C13H14F3NO4/c14-13(15,16)12(20)17-10(7-18)6-11(19)21-8-9-4-2-1-3-5-9/h1-5,10,18H,6-8H2,(H,17,20)
InChIKey DZFWFAOXFINBEG-UHFFFAOYSA-N
Mol Weight 305.25 g/mol
Molecular Formula C13H14F3NO4
Exact Mass 305.087492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dSkf7ENLk
Name 4-Hydroxy-3-(2',2',2'-trifluoroacetylamino)butanoic acid - Benzyl ester
Alternate Name(s) Benzyl 4-hydroxy-3-(2,2,2-trifluoroacetamido)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F3NO4
InChI InChI=1S/C13H14F3NO4/c14-13(15,16)12(20)17-10(7-18)6-11(19)21-8-9-4-2-1-3-5-9/h1-5,10,18H,6-8H2,(H,17,20)
InChIKey DZFWFAOXFINBEG-UHFFFAOYSA-N
Molecular Weight 305.253 g/mol
SMILES N(C(C(F)(F)F)=O)C(CO)CC(=O)OCc1ccccc1
SPLASH splash10-0a4l-7900000000-cbd61480a5e321096211
Source of Spectrum F5-2-111-C
Wiley ID 1731648