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1-(4-Tert-butylphenyl)sulfonyl-4-(3-chloranyl-4-methyl-phenyl)piperazine
SpectraBase Compound ID 2ORmYFbNA23
InChI InChI=1S/C21H27ClN2O2S/c1-16-5-8-18(15-20(16)22)23-11-13-24(14-12-23)27(25,26)19-9-6-17(7-10-19)21(2,3)4/h5-10,15H,11-14H2,1-4H3
InChIKey NESSMKAHWALGQK-UHFFFAOYSA-N
Mol Weight 406.97 g/mol
Molecular Formula C21H27ClN2O2S
Exact Mass 406.148177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKqT1pJVtot
Name 1-(4-tert-butylphenyl)sulfonyl-4-(3-chloranyl-4-methyl-phenyl)piperazine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27ClN2O2S
InChI InChI=1S/C21H27ClN2O2S/c1-16-5-8-18(15-20(16)22)23-11-13-24(14-12-23)27(25,26)19-9-6-17(7-10-19)21(2,3)4/h5-10,15H,11-14H2,1-4H3
InChIKey NESSMKAHWALGQK-UHFFFAOYSA-N
Molecular Weight 406.972 g/mol
SMILES Cc1ccc(N2CCN(S(c3ccc(C(C)(C)C)cc3)(=O)=O)CC2)cc1Cl
SPLASH splash10-0a4i-3690500000-25f3c338c7833ffe7eb4
Synonyms 1-(4-tert-butylphenyl)sulfonyl-4-(3-chloro-4-methyl-phenyl)piperazine
Wiley ID 1442861