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3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]carbamoylamino]propionic acid ethyl ester
SpectraBase Compound ID 8Pgv2MKAkRv
InChI InChI=1S/C13H12F6N2O4/c1-2-24-10(22)9(12(14,15)16)21-11(23)20-7-3-5-8(6-4-7)25-13(17,18)19/h3-6,9H,2H2,1H3,(H2,20,21,23)
InChIKey TZHTYAXPDOANIH-UHFFFAOYSA-N
Mol Weight 374.24 g/mol
Molecular Formula C13H12F6N2O4
Exact Mass 374.070126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pqzhueWDy6
Name 3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]carbamoylamino]propionic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F6N2O4
InChI InChI=1S/C13H12F6N2O4/c1-2-24-10(22)9(12(14,15)16)21-11(23)20-7-3-5-8(6-4-7)25-13(17,18)19/h3-6,9H,2H2,1H3,(H2,20,21,23)
InChIKey TZHTYAXPDOANIH-UHFFFAOYSA-N
Molecular Weight 374.239 g/mol
SMILES N(c1ccc(cc1)OC(F)(F)F)C(=O)NC(C(F)(F)F)C(=O)OCC
SPLASH splash10-056r-6910000000-2136dad1432ece0e2fa1
Synonyms 3,3,3-trifluoro-2-[[oxo-[4-(trifluoromethoxy)anilino]methyl]amino]propanoic acid ethyl ester Ethyl 3,3,3-trifluoro-2-(([4-(trifluoromethoxy)anilino]carbonyl)amino)propanoate Ethyl 3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]carbamoylamino]propanoate Ethyl 3,3,3-tris(fluoranyl)-2-[[4-(trifluoromethyloxy)phenyl]carbamoylamino]propanoate
Wiley ID 1468032