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1-(3-Chlorophenyl)-4-[(2-methoxy-5-methylphenyl)sulfonyl]piperazine
SpectraBase Compound ID A5SwThbOvMp
InChI InChI=1S/C18H21ClN2O3S/c1-14-6-7-17(24-2)18(12-14)25(22,23)21-10-8-20(9-11-21)16-5-3-4-15(19)13-16/h3-7,12-13H,8-11H2,1-2H3
InChIKey FIUBDQLSABCXMN-UHFFFAOYSA-N
Mol Weight 380.89 g/mol
Molecular Formula C18H21ClN2O3S
Exact Mass 380.096141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kvWDoolHmS
Name 1-(3-Chlorophenyl)-4-[(2-methoxy-5-methylphenyl)sulfonyl]piperazine
Alternate Name(s) Piperazine, 1-(3-chlorophenyl)-4-(2-methoxy-5-methylbenzenesulfonyl)- 1-(3-Chlorophenyl)-4-(2-methoxy-5-methylphenyl)sulfonylpiperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClN2O3S
InChI InChI=1S/C18H21ClN2O3S/c1-14-6-7-17(24-2)18(12-14)25(22,23)21-10-8-20(9-11-21)16-5-3-4-15(19)13-16/h3-7,12-13H,8-11H2,1-2H3
InChIKey FIUBDQLSABCXMN-UHFFFAOYSA-N
Molecular Weight 380.890 g/mol
SMILES COc1c(S(N2CCN(CC2)c2cc(Cl)ccc2)(=O)=O)cc(cc1)C
SPLASH splash10-0002-4900000000-7aed315c2d79c3a7617a
Wiley ID 1442030