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

*Links on SpectraBase are not permalinks.
Piperazine, 1-[[4-methoxy-2-methyl-5-(1-methylethyl)phenyl]sulfonyl]-4-(4-methoxyphenyl)-
SpectraBase Compound ID GpSNnTOLW8n
InChI InChI=1S/C22H30N2O4S/c1-16(2)20-15-22(17(3)14-21(20)28-5)29(25,26)24-12-10-23(11-13-24)18-6-8-19(27-4)9-7-18/h6-9,14-16H,10-13H2,1-5H3
InChIKey LLGNRNKTMFDLCB-UHFFFAOYSA-N
Mol Weight 418.55 g/mol
Molecular Formula C22H30N2O4S
Exact Mass 418.192629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Hj8ffjRwmEl
Name Piperazine, 1-[[4-methoxy-2-methyl-5-(1-methylethyl)phenyl]sulfonyl]-4-(4-methoxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.192628624 u
Formula C22H30N2O4S
InChI InChI=1S/C22H30N2O4S/c1-16(2)20-15-22(17(3)14-21(20)28-5)29(25,26)24-12-10-23(11-13-24)18-6-8-19(27-4)9-7-18/h6-9,14-16H,10-13H2,1-5H3
InChIKey LLGNRNKTMFDLCB-UHFFFAOYSA-N
Molecular Weight 418.552 g/mol
SMILES COC=1C=CC(N2CCN(S(C=3C=C(C(C)C)C(=CC3C)OC)(=O)=O)CC2)=CC1