SpectraBase Compound ID | 86x9mMonySy |
---|---|
InChI | InChI=1S/C17H16F3NO/c1-11-15(12-5-3-2-4-6-12)22-16(21-11)13-7-9-14(10-8-13)17(18,19)20/h2-11,15-16,21H,1H3/t11-,15-,16-/m0/s1 |
InChIKey | ZEOBFRLROLOHDL-UVBJJODRSA-N |
Mol Weight | 307.32 g/mol |
Molecular Formula | C17H16F3NO |
Exact Mass | 307.118399 g/mol |
Enantiomer InChIKey | ZEOBFRLROLOHDL-HFBAOOFYSA-N |
Title | Journal or Book | Year |
---|---|---|
Substituent Influences on the Stability of the Ring and Chain Tautomers in 1,3-O,N-Heterocyclic Systems: Characterization by 13C NMR Chemical Shifts, PM3 Charge Densities, and Isodesmic Reactions | The Journal of Organic Chemistry | 2001 |
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