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o-Anisidine, N-heptafluorobutyryl-
SpectraBase Compound ID AO29fJWIy2F
InChI InChI=1S/C11H8F7NO2/c1-21-7-5-3-2-4-6(7)19-8(20)9(12,13)10(14,15)11(16,17)18/h2-5H,1H3,(H,19,20)
InChIKey IJXIWGZJVJFZRZ-UHFFFAOYSA-N
Mol Weight 319.18 g/mol
Molecular Formula C11H8F7NO2
Exact Mass 319.044326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HWTtk8Kc22d
Name o-Anisidine, N-heptafluorobutyryl-
Comments Computed using HOSE algorithm
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Exact Mass 319.044325641 u
Formula C11H8F7NO2
InChI InChI=1S/C11H8F7NO2/c1-21-7-5-3-2-4-6(7)19-8(20)9(12,13)10(14,15)11(16,17)18/h2-5H,1H3,(H,19,20)
InChIKey IJXIWGZJVJFZRZ-UHFFFAOYSA-N
Molecular Weight 319.179 g/mol
SMILES C1(=C(OC)C=CC=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F