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1-(3-Chloranyl-4-methyl-phenyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine
SpectraBase Compound ID 5Fe0RW9r426
InChI InChI=1S/C19H23ClN2O4S/c1-14-4-5-15(12-17(14)20)21-8-10-22(11-9-21)27(23,24)16-6-7-18(25-2)19(13-16)26-3/h4-7,12-13H,8-11H2,1-3H3
InChIKey KBAZQYXVNXEEKL-UHFFFAOYSA-N
Mol Weight 410.92 g/mol
Molecular Formula C19H23ClN2O4S
Exact Mass 410.106706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kX6qUGgwGs
Name 1-(3-Chloranyl-4-methyl-phenyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine
Alternate Name(s) 1-(3-Chloro-4-methyl-phenyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23ClN2O4S
InChI InChI=1S/C19H23ClN2O4S/c1-14-4-5-15(12-17(14)20)21-8-10-22(11-9-21)27(23,24)16-6-7-18(25-2)19(13-16)26-3/h4-7,12-13H,8-11H2,1-3H3
InChIKey KBAZQYXVNXEEKL-UHFFFAOYSA-N
Molecular Weight 410.916 g/mol
SMILES COc1ccc(S(N2CCN(CC2)c2cc(Cl)c(cc2)C)(=O)=O)cc1OC
SPLASH splash10-0bt9-4690200000-7c7180e0d3161402af6e
Wiley ID 1442858