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L-Phenylalanine, N-(trifluoroacetyl)-, 1-methylpropyl ester
SpectraBase Compound ID JgtIxfsaanI
InChI InChI=1S/C15H18F3NO3/c1-3-10(2)22-13(20)12(19-14(21)15(16,17)18)9-11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3,(H,19,21)
InChIKey LCRANUUOTCSXEG-UHFFFAOYSA-N
Mol Weight 317.31 g/mol
Molecular Formula C15H18F3NO3
Exact Mass 317.123878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZBdwk8mIHw
Name L-Phenylalanine, N-(trifluoroacetyl)-, 1-methylpropyl ester
Alternate Name(s) Sec-butyl 3-phenyl-2-[(trifluoroacetyl)amino]propanoate 3-Phenyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid butan-2-yl ester 3-Phenyl-2-[(2,2,2-trifluoroacetyl)amino]propionic acid sec-butyl ester Butan-2-yl 3-phenyl-2-[(2,2,2-trifluoroacetyl)amino]propanoate Butan-2-yl 3-phenyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate sec-butyl 3-phenyl-2-[(2,2,2-trifluoroacetyl)amino]propanoate
CAS Registry Number 58072-44-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18F3NO3
InChI InChI=1S/C15H18F3NO3/c1-3-10(2)22-13(20)12(19-14(21)15(16,17)18)9-11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3,(H,19,21)
InChIKey LCRANUUOTCSXEG-UHFFFAOYSA-N
Molecular Weight 317.308 g/mol
SMILES N(C(Cc1ccccc1)C(=O)OC(C)CC)C(C(F)(F)F)=O
SPLASH splash10-0006-9600000000-6b55268ddd3aea74731f
Source of Spectrum W5-28530-0-0
Wiley ID 1317567