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5-ISOBUTYL-4-METHYL-2-(2,2,2-TRIFLUOROETHYLIDENE)-6-TRIFLUOROMETHYL-2,3-DIHYDRO-4H-1,4-OXAZIN-3-ONE
SpectraBase Compound ID znoPtCRxU5
InChI InChI=1S/C12H13F6NO2/c1-6(2)4-7-9(12(16,17)18)21-8(5-11(13,14)15)10(20)19(7)3/h5-6H,4H2,1-3H3/b8-5-
InChIKey NGHNQBSUOLMCLZ-YVMONPNESA-N
Mol Weight 317.23 g/mol
Molecular Formula C12H13F6NO2
Exact Mass 317.085048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uIXt2bAYAA
Name (2Z)-4-methyl-5-(2-methylpropyl)-2-(2,2,2-trifluoroethylidene)-6-(trifluoromethyl)-1,4-oxazin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H13F6NO2
InChI InChI=1S/C12H13F6NO2/c1-6(2)4-7-9(12(16,17)18)21-8(5-11(13,14)15)10(20)19(7)3/h5-6H,4H2,1-3H3/b8-5-
InChIKey NGHNQBSUOLMCLZ-YVMONPNESA-N
Molecular Weight 317.231 g/mol
SMILES C1(=C(N(C)C(\C(O1)=C\C(F)(F)F)=O)CC(C)C)C(F)(F)F
SPLASH splash10-0aor-0097000000-dc591557d881c9538d40
Source of Spectrum H1-45-2189-2
Synonyms (2Z)-4-methyl-5-(2-methylpropyl)-6-(trifluoromethyl)-2-[2,2,2-tris(fluoranyl)ethylidene]-1,4-oxazin-3-one (2Z)-5-isobutyl-4-methyl-2-(2,2,2-trifluoroethylidene)-6-(trifluoromethyl)-1,4-oxazin-3-one
Wiley ID 815909