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Piperazine, 1-[(4-methylphenyl)sulfonyl]-4-[(3-phenoxyphenyl)methyl]-

View entire compound with spectra: 2 NMR

Piperazine, 1-[(4-methylphenyl)sulfonyl]-4-[(3-phenoxyphenyl)methyl]-
SpectraBase Compound ID 8PMox8cxdUI
InChI InChI=1S/C24H26N2O3S/c1-20-10-12-24(13-11-20)30(27,28)26-16-14-25(15-17-26)19-21-6-5-9-23(18-21)29-22-7-3-2-4-8-22/h2-13,18H,14-17,19H2,1H3
InChIKey GNUDRRVWOLKUDT-UHFFFAOYSA-N
Mol Weight 422.54 g/mol
Molecular Formula C24H26N2O3S
Exact Mass 422.166414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID o7QrxgrTXH
Name Piperazine, 1-[(4-methylphenyl)sulfonyl]-4-[(3-phenoxyphenyl)methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.166413876 u
Formula C24H26N2O3S
InChI InChI=1S/C24H26N2O3S/c1-20-10-12-24(13-11-20)30(27,28)26-16-14-25(15-17-26)19-21-6-5-9-23(18-21)29-22-7-3-2-4-8-22/h2-13,18H,14-17,19H2,1H3
InChIKey GNUDRRVWOLKUDT-UHFFFAOYSA-N
Molecular Weight 422.543 g/mol
SMILES C1=CC=C(OC2=CC(CN3CCN(S(C4=CC=C(C=C4)C)(=O)=O)CC3)=CC=C2)C=C1