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1-(3-Chloranyl-4-methyl-phenyl)-4-(2,4,5-trimethylphenyl)sulfonyl-piperazine
SpectraBase Compound ID KE5WBjaK1r1
InChI InChI=1S/C20H25ClN2O2S/c1-14-5-6-18(13-19(14)21)22-7-9-23(10-8-22)26(24,25)20-12-16(3)15(2)11-17(20)4/h5-6,11-13H,7-10H2,1-4H3
InChIKey HTCVOGDMWZPFSL-UHFFFAOYSA-N
Mol Weight 392.95 g/mol
Molecular Formula C20H25ClN2O2S
Exact Mass 392.132527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Wa3SP0LvEi
Name 1-(3-Chloranyl-4-methyl-phenyl)-4-(2,4,5-trimethylphenyl)sulfonyl-piperazine
Alternate Name(s) 1-(3-Chloro-4-methyl-phenyl)-4-(2,4,5-trimethylphenyl)sulfonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25ClN2O2S
InChI InChI=1S/C20H25ClN2O2S/c1-14-5-6-18(13-19(14)21)22-7-9-23(10-8-22)26(24,25)20-12-16(3)15(2)11-17(20)4/h5-6,11-13H,7-10H2,1-4H3
InChIKey HTCVOGDMWZPFSL-UHFFFAOYSA-N
Molecular Weight 392.945 g/mol
SMILES Cc1ccc(N2CCN(S(c3cc(C)c(cc3C)C)(=O)=O)CC2)cc1Cl
SPLASH splash10-0a4l-3793000000-28566195b6c4196d703a
Wiley ID 1442863