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N-(Cyclopropylmethyl)-N-methyl-3'-(2-methylpropanoyl)-5'-(trifluoromethyl)-1,1'-biphenyl-4-sulfonamide
SpectraBase Compound ID fwkZB5KpSm
InChI InChI=1S/C22H24F3NO3S/c1-14(2)21(27)18-10-17(11-19(12-18)22(23,24)25)16-6-8-20(9-7-16)30(28,29)26(3)13-15-4-5-15/h6-12,14-15H,4-5,13H2,1-3H3
InChIKey UOXSHHPQSJZBLW-UHFFFAOYSA-N
Mol Weight 439.49 g/mol
Molecular Formula C22H24F3NO3S
Exact Mass 439.142899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZ60bP6G8zK
Name N-(Cyclopropylmethyl)-N-methyl-3'-(2-methylpropanoyl)-5'-(trifluoromethyl)-1,1'-biphenyl-4-sulfonamide
Appearance White solid
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Exact Mass 439.142899297 u
Formula C22H24F3NO3S
InChI InChI=1S/C22H24F3NO3S/c1-14(2)21(27)18-10-17(11-19(12-18)22(23,24)25)16-6-8-20(9-7-16)30(28,29)26(3)13-15-4-5-15/h6-12,14-15H,4-5,13H2,1-3H3
InChIKey UOXSHHPQSJZBLW-UHFFFAOYSA-N
Instrument Name Waters Micromass AutoSpec-Ultima
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703244
Molecular Weight 439.493 g/mol
Reported Formula C22H24F3NO3S
SMILES C1(C2=CC=C(C=C2)S(N(C)CC2CC2)(=O)=O)=CC(=CC(=C1)C(C(C)C)=O)C(F)(F)F
SPLASH splash10-052b-0009300000-1f313c456f971803c40d
Source of Spectrum QE-23-SM46-25l (DOI: 10.1002/chem.201703244)
Thin-Layer Chromatography 0.23 (SiO2, cyclohexane/EtOAc, 85:15)
Wiley ID 1907849