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Ethyl (2S)-5,5,5-trifluoro-2-{ [(2R)-1-phenylethyl]amino}-4-(trifluoromethyl)pentanoate
SpectraBase Compound ID 5jE7ojN8Uyb
InChI InChI=1S/C16H19F6NO2/c1-3-25-14(24)12(9-13(15(17,18)19)16(20,21)22)23-10(2)11-7-5-4-6-8-11/h4-8,10,12-13,23H,3,9H2,1-2H3/t10?,12-/m1/s1
InChIKey PTRAWNGEKKVJOC-TVKKRMFBSA-N
Mol Weight 371.32 g/mol
Molecular Formula C16H19F6NO2
Exact Mass 371.131998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vulAzSdU7P
Name Ethyl (2S)-5,5,5-trifluoro-2-{ [(2R)-1-phenylethyl]amino}-4-(trifluoromethyl)pentanoate
Alternate Name(s) Ethyl (2R)-5,5,5-trifluoro-2-{ [(2R)-1-phenylethyl]amino}-4-(trifluoromethyl)pentanoate Ethyl (2R)-5,5,5-trifluoro-2-[(1-phenylethyl)amino]-4-(trifluoromethyl)pentanoate Ethyl (2R)-5,5,5-trifluoro-2-{[(2R)-1-phenylethyl]amino}-4-(trifluoromethyl)pentanoate Ethyl (2S)-5,5,5-trifluoro-2-{[(2R)-1-phenylethyl]amino}-4-(trifluoromethyl)pentanoate
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Formula C16H19F6NO2
InChI InChI=1S/C16H19F6NO2/c1-3-25-14(24)12(9-13(15(17,18)19)16(20,21)22)23-10(2)11-7-5-4-6-8-11/h4-8,10,12-13,23H,3,9H2,1-2H3/t10?,12-/m1/s1
InChIKey PTRAWNGEKKVJOC-TVKKRMFBSA-N
Molecular Weight 371.323 g/mol
SMILES N([C@](CC(C(F)(F)F)C(F)(F)F)(C(=O)OCC)[H])C(c1ccccc1)C
SPLASH splash10-0a4j-0943000000-5109462975b392fa9310
Source of Spectrum H-81-179-10
Wiley ID 1354850