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Piperazine, 1-(2,6-dimethylphenyl)-4-(4-fluorobenzenesulfonyl)-
SpectraBase Compound ID BjntXDCymXq
InChI InChI=1S/C18H21FN2O2S/c1-14-4-3-5-15(2)18(14)20-10-12-21(13-11-20)24(22,23)17-8-6-16(19)7-9-17/h3-9H,10-13H2,1-2H3
InChIKey YCUJTBKQNNHYMV-UHFFFAOYSA-N
Mol Weight 348.44 g/mol
Molecular Formula C18H21FN2O2S
Exact Mass 348.130777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K1R5GrNVOF4
Name Piperazine, 1-(2,6-dimethylphenyl)-4-(4-fluorobenzenesulfonyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.130777259 u
Formula C18H21FN2O2S
InChI InChI=1S/C18H21FN2O2S/c1-14-4-3-5-15(2)18(14)20-10-12-21(13-11-20)24(22,23)17-8-6-16(19)7-9-17/h3-9H,10-13H2,1-2H3
InChIKey YCUJTBKQNNHYMV-UHFFFAOYSA-N
Molecular Weight 348.436 g/mol
SMILES CC1=C(C(C)=CC=C1)N1CCN(S(C2=CC=C(C=C2)F)(=O)=O)CC1