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

*Links on SpectraBase are not permalinks.
Phenyl[4-(N-phenylphenylsulfonimidoyl)piperazin-1-yl]methanone
SpectraBase Compound ID 4WhIpItSA2q
InChI InChI=1S/C23H23N3O2S/c27-23(20-10-4-1-5-11-20)25-16-18-26(19-17-25)29(28,22-14-8-3-9-15-22)24-21-12-6-2-7-13-21/h1-15H,16-19H2
InChIKey XKVIAGIYGBLAJN-UHFFFAOYSA-N
Mol Weight 405.52 g/mol
Molecular Formula C23H23N3O2S
Exact Mass 405.151098 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 41vh0wWjA0
Name Phenyl[4-(N-phenylphenylsulfonimidoyl)piperazin-1-yl]methanone
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.151098165 u
Formula C23H23N3O2S
InChI InChI=1S/C23H23N3O2S/c27-23(20-10-4-1-5-11-20)25-16-18-26(19-17-25)29(28,22-14-8-3-9-15-22)24-21-12-6-2-7-13-21/h1-15H,16-19H2
InChIKey XKVIAGIYGBLAJN-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810548
Molecular Weight 405.516 g/mol
Quality 108
Reported Formula C23H23N3O2S
SMILES C1(S(N2CCN(CC2)C(=O)C2=CC=CC=C2)(=NC2=CC=CC=C2)=O)=CC=CC=C1
SPLASH splash10-0aor-0920400000-4da6d5f1e3f3997c108a
Source of Spectrum ACI-57-SM15-8ag (DOI: 10.1002/anie.201810548)
Thin-Layer Chromatography 0.26 (pentane/EtOAc, 1:1)
Wiley ID 1893596