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2,4,6-Trimethyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide, N-methyl
SpectraBase Compound ID IpW6OTfiAkR
InChI InChI=1S/C17H18F3NO2S/c1-11-8-12(2)16(13(3)9-11)24(22,23)21(4)15-7-5-6-14(10-15)17(18,19)20/h5-10H,1-4H3
InChIKey NXEUQALXDGRGAH-UHFFFAOYSA-N
Mol Weight 357.39 g/mol
Molecular Formula C17H18F3NO2S
Exact Mass 357.101034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6OSU9AreeO2
Name 2,4,6-Trimethyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide, N-methyl
Comments Computed using HOSE algorithm
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Exact Mass 357.101034485 u
Formula C17H18F3NO2S
InChI InChI=1S/C17H18F3NO2S/c1-11-8-12(2)16(13(3)9-11)24(22,23)21(4)15-7-5-6-14(10-15)17(18,19)20/h5-10H,1-4H3
InChIKey NXEUQALXDGRGAH-UHFFFAOYSA-N
Molecular Weight 357.391 g/mol
SMILES C1(=C(C=C(C=C1C)C)C)S(=O)(=O)N(C1=CC(=CC=C1)C(F)(F)F)C