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2,6-Dimethyl-3'-(trifluoromethyl)carbanilide
SpectraBase Compound ID 6r54krdt5uI
InChI InChI=1S/C16H15F3N2O/c1-10-5-3-6-11(2)14(10)21-15(22)20-13-8-4-7-12(9-13)16(17,18)19/h3-9H,1-2H3,(H2,20,21,22)
InChIKey UNYFEHIIUPSRKU-UHFFFAOYSA-N
Mol Weight 308.3 g/mol
Molecular Formula C16H15F3N2O
Exact Mass 308.113648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TgnQ4TqN0k
Name 2,6-Dimethyl-3'-(trifluoromethyl)carbanilide
Comments Computed using HOSE algorithm
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Exact Mass 308.113647599 u
Formula C16H15F3N2O
InChI InChI=1S/C16H15F3N2O/c1-10-5-3-6-11(2)14(10)21-15(22)20-13-8-4-7-12(9-13)16(17,18)19/h3-9H,1-2H3,(H2,20,21,22)
InChIKey UNYFEHIIUPSRKU-UHFFFAOYSA-N
Molecular Weight 308.304 g/mol
SMILES N(C=1C(=CC=CC1C)C)C(NC1=CC(=CC=C1)C(F)(F)F)=O