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Ethyl 3, 3, 3-trifluoro-2-(5-methyl-1H-indol-3-yl)-2-(1-phenylethylamino)propanoate
SpectraBase Compound ID Exm1g3CkTMD
InChI InChI=1S/C22H23F3N2O2/c1-4-29-20(28)21(22(23,24)25,27-15(3)16-8-6-5-7-9-16)18-13-26-19-11-10-14(2)12-17(18)19/h5-13,15,26-27H,4H2,1-3H3
InChIKey KFRILRPDSQFJEP-UHFFFAOYSA-N
Mol Weight 404.43 g/mol
Molecular Formula C22H23F3N2O2
Exact Mass 404.171162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WlOnsHluqE
Name Ethyl 3, 3, 3-trifluoro-2-(5-methyl-1H-indol-3-yl)-2-(1-phenylethylamino)propanoate
Alternate Name(s) Ethyl 3,3,3-trifluoro-2-(5-methyl-1H-indol-3-yl)-2-((1-phenylethyl)amino)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23F3N2O2
InChI InChI=1S/C22H23F3N2O2/c1-4-29-20(28)21(22(23,24)25,27-15(3)16-8-6-5-7-9-16)18-13-26-19-11-10-14(2)12-17(18)19/h5-13,15,26-27H,4H2,1-3H3
InChIKey KFRILRPDSQFJEP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201100569
Molecular Weight 404.433 g/mol
SMILES [nH]1cc(C(C(OCC)=O)(C(F)(F)F)NC(c2ccccc2)C)c2cc(ccc12)C
SPLASH splash10-057i-1794000000-32ca7291c926fcb17a01
Source of Spectrum CMC-7-910/SM21-21_2
Wiley ID 1771803