For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(Cyclobutylmethyl)-N-methyl-3'-(2-methylpropanoyl)-5'-(trifluoromethyl)-1,1???-biphenyl-4-sulfonamide
SpectraBase Compound ID 6GISI7ipIF
InChI InChI=1S/C23H26F3NO3S/c1-15(2)22(28)19-11-18(12-20(13-19)23(24,25)26)17-7-9-21(10-8-17)31(29,30)27(3)14-16-5-4-6-16/h7-13,15-16H,4-6,14H2,1-3H3
InChIKey VURFIZKFFMFMMO-UHFFFAOYSA-N
Mol Weight 453.52 g/mol
Molecular Formula C23H26F3NO3S
Exact Mass 453.158549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KLxEE9mmQg5
Name N-(Cyclobutylmethyl)-N-methyl-3'-(2-methylpropanoyl)-5'-(trifluoromethyl)-1,1???-biphenyl-4-sulfonamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.158549361 u
Formula C23H26F3NO3S
InChI InChI=1S/C23H26F3NO3S/c1-15(2)22(28)19-11-18(12-20(13-19)23(24,25)26)17-7-9-21(10-8-17)31(29,30)27(3)14-16-5-4-6-16/h7-13,15-16H,4-6,14H2,1-3H3
InChIKey VURFIZKFFMFMMO-UHFFFAOYSA-N
Instrument Name Waters Micromass AutoSpec-Ultima
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703244
Molecular Weight 453.520 g/mol
Reported Formula C23H26F3NO3S
SMILES C1(C2=CC=C(C=C2)S(N(C)CC2CCC2)(=O)=O)=CC(=CC(=C1)C(C(C)C)=O)C(F)(F)F
SPLASH splash10-0002-0009000000-382fab5f2996afd4a178
Source of Spectrum QE-23-SM47-25m (DOI: 10.1002/chem.201703244)
Thin-Layer Chromatography 0.41 (SiO2, cyclohexane/EtOAc, 90:10)
Wiley ID 1907850