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Ethyl 2-butyramido-3,3,3-trifluoro-2-[3-(trifluoromethyl)anilino]propionate
SpectraBase Compound ID 3ojsETmfcGi
InChI InChI=1S/C16H18F6N2O3/c1-3-6-12(25)24-14(16(20,21)22,13(26)27-4-2)23-11-8-5-7-10(9-11)15(17,18)19/h5,7-9,23H,3-4,6H2,1-2H3,(H,24,25)
InChIKey IPCPNIKKLVAXQA-UHFFFAOYSA-N
Mol Weight 400.32 g/mol
Molecular Formula C16H18F6N2O3
Exact Mass 400.122161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9ILb7s7ACQ
Name ETHYL 2-BUTYRAMIDO-3,3,3-TRIFLUORO-2-[3-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H18F6N2O3
InChI InChI=1S/C16H18F6N2O3/c1-3-6-12(25)24-14(16(20,21)22,13(26)27-4-2)23-11-8-5-7-10(9-11)15(17,18)19/h5,7-9,23H,3-4,6H2,1-2H3,(H,24,25)
InChIKey IPCPNIKKLVAXQA-UHFFFAOYSA-N
Molecular Weight 400.1217
SMILES N(C(C(F)(F)F)(C(OCC)=O)NC(=O)CCC)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0596-9240000000-7183ea2f13badbcdd1ee
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany