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3-(4-Hydroxy-3,5-dimethylphenyl)-3-(trifluoromethyl)-2-piperazinone
SpectraBase Compound ID IWVIjxmocPs
InChI InChI=1S/C13H15F3N2O2/c1-7-5-9(6-8(2)10(7)19)12(13(14,15)16)11(20)17-3-4-18-12/h5-6,18-19H,3-4H2,1-2H3,(H,17,20)
InChIKey DPIVHITUBMABRN-UHFFFAOYSA-N
Mol Weight 288.27 g/mol
Molecular Formula C13H15F3N2O2
Exact Mass 288.108562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9RwU2nfy71
Name 3-(4-Hydroxy-3,5-dimethylphenyl)-3-(trifluoromethyl)-2-piperazinone
Alternate Name(s) 3-(3,5-dimethyl-4-oxidanyl-phenyl)-3-(trifluoromethyl)piperazin-2-one 3-(4-hydroxy-3,5-dimethyl-phenyl)-3-(trifluoromethyl)piperazin-2-one Piperazin-2-one, 3-(4-hydroxy-3,5-dimethylphenyl)-3-trifluoromethyl-
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Formula C13H15F3N2O2
InChI InChI=1S/C13H15F3N2O2/c1-7-5-9(6-8(2)10(7)19)12(13(14,15)16)11(20)17-3-4-18-12/h5-6,18-19H,3-4H2,1-2H3,(H,17,20)
InChIKey DPIVHITUBMABRN-UHFFFAOYSA-N
Molecular Weight 288.270 g/mol
SMILES Oc1c(cc(C2(C(F)(F)F)C(NCCN2)=O)cc1C)C
SPLASH splash10-014i-2590000000-34ba5c380ed7478344b6
Wiley ID 1441971