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1-(1,3-Benzodioxol-5-ylmethyl)-4-{[4-(methylsulfanyl)phenyl]sulfonyl}piperazine
SpectraBase Compound ID ArMZZ1hb9wv
InChI InChI=1S/C19H22N2O4S2/c1-26-16-3-5-17(6-4-16)27(22,23)21-10-8-20(9-11-21)13-15-2-7-18-19(12-15)25-14-24-18/h2-7,12H,8-11,13-14H2,1H3
InChIKey MUQQAMPVUMLYOY-UHFFFAOYSA-N
Mol Weight 406.52 g/mol
Molecular Formula C19H22N2O4S2
Exact Mass 406.1021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4CwAiDsQ1w
Name 1-(1,3-Benzodioxol-5-ylmethyl)-4-{[4-(methylsulfanyl)phenyl]sulfonyl}piperazine
Alternate Name(s) 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(methylthio)phenyl]sulfonylpiperazine 1-[4-(methylthio)phenyl]sulfonyl-4-piperonyl-piperazine 4-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}phenyl methyl sulfide 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylsulfanylphenyl)sulfonylpiperazine
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Formula C19H22N2O4S2
InChI InChI=1S/C19H22N2O4S2/c1-26-16-3-5-17(6-4-16)27(22,23)21-10-8-20(9-11-21)13-15-2-7-18-19(12-15)25-14-24-18/h2-7,12H,8-11,13-14H2,1H3
InChIKey MUQQAMPVUMLYOY-UHFFFAOYSA-N
Molecular Weight 406.515 g/mol
SMILES C1N(CCN(C1)Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(cc1)SC
SPLASH splash10-000i-4930000000-55c173303df5e8659365
Wiley ID 1444779