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Piperazine, 1-[(2-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)sulfonyl]-

View entire compound with spectra: 2 NMR

Piperazine, 1-[(2-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)sulfonyl]-
SpectraBase Compound ID 1azZIUDxNim
InChI InChI=1S/C19H23FN2O3S/c1-2-25-19-6-4-3-5-16(19)15-21-11-13-22(14-12-21)26(23,24)18-9-7-17(20)8-10-18/h3-10H,2,11-15H2,1H3
InChIKey SIJPXTKQCYGEAK-UHFFFAOYSA-N
Mol Weight 378.46 g/mol
Molecular Formula C19H23FN2O3S
Exact Mass 378.141342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2OxDyLRVk1
Name Piperazine, 1-[(2-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)sulfonyl]-
Comments Computed using HOSE algorithm
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Exact Mass 378.141341943 u
Formula C19H23FN2O3S
InChI InChI=1S/C19H23FN2O3S/c1-2-25-19-6-4-3-5-16(19)15-21-11-13-22(14-12-21)26(23,24)18-9-7-17(20)8-10-18/h3-10H,2,11-15H2,1H3
InChIKey SIJPXTKQCYGEAK-UHFFFAOYSA-N
Molecular Weight 378.462 g/mol
SMILES C1=CC=C(CN2CCN(S(C=3C=CC(=CC3)F)(=O)=O)CC2)C(OCC)=C1