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Ethyl 3,3,3-trifluoro-2-propionamido-2-[3-(trifluoromethyl)anilino]propionate

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Ethyl 3,3,3-trifluoro-2-propionamido-2-[3-(trifluoromethyl)anilino]propionate
SpectraBase Compound ID 4KgLE54Rwb0
InChI InChI=1S/C15H16F6N2O3/c1-3-11(24)23-13(15(19,20)21,12(25)26-4-2)22-10-7-5-6-9(8-10)14(16,17)18/h5-8,22H,3-4H2,1-2H3,(H,23,24)
InChIKey SDYVKNAVQFHCGS-UHFFFAOYSA-N
Mol Weight 386.29 g/mol
Molecular Formula C15H16F6N2O3
Exact Mass 386.106511 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9DA9gk6xxdI
Name Ethyl 3,3,3-trifluoro-2-propionamido-2-[3-(trifluoromethyl)anilino]propionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.106511358 u
Formula C15H16F6N2O3
InChI InChI=1S/C15H16F6N2O3/c1-3-11(24)23-13(15(19,20)21,12(25)26-4-2)22-10-7-5-6-9(8-10)14(16,17)18/h5-8,22H,3-4H2,1-2H3,(H,23,24)
InChIKey SDYVKNAVQFHCGS-UHFFFAOYSA-N
Molecular Weight 386.294 g/mol
SMILES C(NC(C(OCC)=O)(NC1=CC(C(F)(F)F)=CC=C1)C(F)(F)F)(CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.83197