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Benzamide, pentafluoro-N-(pentafluorobenzoyl)-N-butyl-
SpectraBase Compound ID HBY4cWRjQAg
InChI InChI=1S/C18H9F10NO2/c1-2-3-4-29(17(30)5-7(19)11(23)15(27)12(24)8(5)20)18(31)6-9(21)13(25)16(28)14(26)10(6)22/h2-4H2,1H3
InChIKey ZHIDUFZTAONMNX-UHFFFAOYSA-N
Mol Weight 461.26 g/mol
Molecular Formula C18H9F10NO2
Exact Mass 461.04736 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3Bfiwz9nWG
Name Benzamide, pentafluoro-N-(pentafluorobenzoyl)-N-butyl-
Comments Computed using HOSE algorithm
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Exact Mass 461.047360162 u
Formula C18H9F10NO2
InChI InChI=1S/C18H9F10NO2/c1-2-3-4-29(17(30)5-7(19)11(23)15(27)12(24)8(5)20)18(31)6-9(21)13(25)16(28)14(26)10(6)22/h2-4H2,1H3
InChIKey ZHIDUFZTAONMNX-UHFFFAOYSA-N
Molecular Weight 461.259 g/mol
SMILES C(N(CCCC)C(C1=C(C(=C(C(=C1F)F)F)F)F)=O)(=O)C=1C(F)=C(C(=C(F)C1F)F)F