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4,4-Dimethyl-2-[(2R,3S)-2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenyl]-2-oxiranyl]-5H-oxazole
SpectraBase Compound ID 8SlyAMY6osZ
InChI InChI=1S/C20H17F3N2O4/c1-18(2)11-28-17(24-18)19(13-7-9-15(10-8-13)25(26)27)16(29-19)12-3-5-14(6-4-12)20(21,22)23/h3-10,16H,11H2,1-2H3/t16-,19+/m0/s1
InChIKey XRSDXQGHGIOPPF-QFBILLFUSA-N
Mol Weight 406.36 g/mol
Molecular Formula C20H17F3N2O4
Exact Mass 406.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLWtLr9G0kJ
Name 4,4-Dimethyl-2-[(2R,3S)-2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenyl]-2-oxiranyl]-5H-oxazole
Alternate Name(s) 4,4-Dimethyl-2-[(2R,3S)-2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenyl]oxiran-2-yl]-2-oxazoline 4,4-Dimethyl-2-[(2R,3S)-2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenyl]oxiran-2-yl]-5H-1,3-oxazole 4,4-Dimethyl-2-[(2R,3S)-2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenyl]oxiran-2-yl]-5H-oxazole
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Formula C20H17F3N2O4
InChI InChI=1S/C20H17F3N2O4/c1-18(2)11-28-17(24-18)19(13-7-9-15(10-8-13)25(26)27)16(29-19)12-3-5-14(6-4-12)20(21,22)23/h3-10,16H,11H2,1-2H3/t16-,19+/m0/s1
InChIKey XRSDXQGHGIOPPF-QFBILLFUSA-N
Molecular Weight 406.361 g/mol
SMILES [C@@]1(O[C@]1(c1ccc(C(F)(F)F)cc1)[H])(C1=NC(C)(C)CO1)c1ccc(N(=O)=O)cc1
SPLASH splash10-0udi-0911000000-e78c55552f787774a289
Source of Spectrum F-69-4964-8
Wiley ID 1595318