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l-Alanine, N-(2-trifluoromethylbenzoyl)-, pentyl ester
SpectraBase Compound ID 9rTRfOKExx6
InChI InChI=1S/C16H20F3NO3/c1-3-4-7-10-23-15(22)11(2)20-14(21)12-8-5-6-9-13(12)16(17,18)19/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,20,21)
InChIKey SBPALFXNOPXTIG-UHFFFAOYSA-N
Mol Weight 331.34 g/mol
Molecular Formula C16H20F3NO3
Exact Mass 331.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7cYO31Fm37
Name l-Alanine, N-(2-trifluoromethylbenzoyl)-, pentyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20F3NO3
InChI InChI=1S/C16H20F3NO3/c1-3-4-7-10-23-15(22)11(2)20-14(21)12-8-5-6-9-13(12)16(17,18)19/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,20,21)
InChIKey SBPALFXNOPXTIG-UHFFFAOYSA-N
Molecular Weight 331.335 g/mol
SMILES N(C(C)C(OCCCCC)=O)C(c1c(cccc1)C(F)(F)F)=O
SPLASH splash10-00xr-2930000000-eb0a9573eadf7aec6775
Source of Spectrum NP-11-7911-0
Synonyms 2-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]propanoic acid pentyl ester Pentyl 2-[[2-(trifluoromethyl)benzoyl]amino]propanoate Pentyl 2-[[2-(trifluoromethyl)phenyl]carbonylamino]propanoate
Wiley ID 1109874