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1-(4-Fluorophenyl)-4-(mesitylsulfonyl)piperazine

View entire compound with spectra: 2 NMR

1-(4-Fluorophenyl)-4-(mesitylsulfonyl)piperazine
SpectraBase Compound ID 1cm3pcHCX9C
InChI InChI=1S/C19H23FN2O2S/c1-14-12-15(2)19(16(3)13-14)25(23,24)22-10-8-21(9-11-22)18-6-4-17(20)5-7-18/h4-7,12-13H,8-11H2,1-3H3
InChIKey WEBPCHGANLBCHC-UHFFFAOYSA-N
Mol Weight 362.46 g/mol
Molecular Formula C19H23FN2O2S
Exact Mass 362.146427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9IshhbKPNde
Name 1-(4-Fluorophenyl)-4-(mesitylsulfonyl)piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.146427324 u
Formula C19H23FN2O2S
InChI InChI=1S/C19H23FN2O2S/c1-14-12-15(2)19(16(3)13-14)25(23,24)22-10-8-21(9-11-22)18-6-4-17(20)5-7-18/h4-7,12-13H,8-11H2,1-3H3
InChIKey WEBPCHGANLBCHC-UHFFFAOYSA-N
Molecular Weight 362.463 g/mol
SMILES CC=1C=C(C(S(N2CCN(CC2)C2=CC=C(C=C2)F)(=O)=O)=C(C1)C)C