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1-(4-Fluorophenyl)-4-[(4-methoxyphenyl)sulfonyl]piperazine

View entire compound with spectra: 3 NMR

1-(4-Fluorophenyl)-4-[(4-methoxyphenyl)sulfonyl]piperazine
SpectraBase Compound ID 9cRIev0Rq5z
InChI InChI=1S/C17H19FN2O3S/c1-23-16-6-8-17(9-7-16)24(21,22)20-12-10-19(11-13-20)15-4-2-14(18)3-5-15/h2-9H,10-13H2,1H3
InChIKey ODDOSZHDNGZWJL-UHFFFAOYSA-N
Mol Weight 350.41 g/mol
Molecular Formula C17H19FN2O3S
Exact Mass 350.110042 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AFDSGcThIul
Name 1-(4-Fluorophenyl)-4-[(4-methoxyphenyl)sulfonyl]piperazine
Comments Computed using HOSE algorithm
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Exact Mass 350.110041814 u
Formula C17H19FN2O3S
InChI InChI=1S/C17H19FN2O3S/c1-23-16-6-8-17(9-7-16)24(21,22)20-12-10-19(11-13-20)15-4-2-14(18)3-5-15/h2-9H,10-13H2,1H3
InChIKey ODDOSZHDNGZWJL-UHFFFAOYSA-N
Molecular Weight 350.408 g/mol
SMILES C=1(C=CC(N2CCN(S(C3=CC=C(C=C3)OC)(=O)=O)CC2)=CC1)F