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3,3,3-trifluoro-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]propionic acid ethyl ester
SpectraBase Compound ID J71WwoaeHt0
InChI InChI=1S/C13H12F6N2O3/c1-2-24-10(22)9(13(17,18)19)21-11(23)20-8-6-4-3-5-7(8)12(14,15)16/h3-6,9H,2H2,1H3,(H2,20,21,23)
InChIKey FSFPPYSFHMWIMY-UHFFFAOYSA-N
Mol Weight 358.24 g/mol
Molecular Formula C13H12F6N2O3
Exact Mass 358.075211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvqpakevipZ
Name ETHYL 3,3,3-TRIFLUORO-2{-3-[2-(TRIFLUOROMETHYL)PHENIL]UREIDO}PROPIONATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12F6N2O3
InChI InChI=1S/C13H12F6N2O3/c1-2-24-10(22)9(13(17,18)19)21-11(23)20-8-6-4-3-5-7(8)12(14,15)16/h3-6,9H,2H2,1H3,(H2,20,21,23)
InChIKey FSFPPYSFHMWIMY-UHFFFAOYSA-N
Molecular Weight 358.0749
SMILES N(C(NC(C(OCC)=O)C(F)(F)F)=O)c1ccccc1C(F)(F)F
SPLASH splash10-03dl-3900000000-724d1f4a22575b466642
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany