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N,N'-bis[(4''-Phenyl-1",2",5"-oxadiazol-3"-yl)methyl]-piperazine - N(2), N'(2)-Dioxide)
SpectraBase Compound ID GrvyYekNK7h
InChI InChI=1S/C22H22N6O4/c29-27-19(21(23-31-27)17-7-3-1-4-8-17)15-25-11-13-26(14-12-25)16-20-22(24-32-28(20)30)18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKey XGVOAUDWCVASFY-UHFFFAOYSA-N
Mol Weight 434.46 g/mol
Molecular Formula C22H22N6O4
Exact Mass 434.170253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfEu1uuJ45R
Name N,N'-bis[(4''-Phenyl-1",2",5"-oxadiazol-3"-yl)methyl]-piperazine - N(2), N'(2)-Dioxide)
Alternate Name(s) 2-Oxido-3-[[4-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methyl]-1-piperazinyl]methyl]-4-phenyl-1,2,5-oxadiazol-2-ium 2-Oxido-3-[[4-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methyl]piperazin-1-yl]methyl]-4-phenyl-1,2,5-oxadiazol-2-ium 2-Oxidanidyl-3-[[4-[(2-oxidanidyl-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methyl]piperazin-1-yl]methyl]-4-phenyl-1,2,5-oxadiazol-2-ium N,N'-Bis[(4-phenyl-1,2,5-oxadiazol-N2-oxide-3-yl)methyl]piperazine 3,3'-(piperazine-1,4-diylbis(methylene))bis(4-phenyl-1,2,5-oxadiazole 2-oxide)
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Formula C22H22N6O4
InChI InChI=1S/C22H22N6O4/c29-27-19(21(23-31-27)17-7-3-1-4-8-17)15-25-11-13-26(14-12-25)16-20-22(24-32-28(20)30)18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKey XGVOAUDWCVASFY-UHFFFAOYSA-N
Molecular Weight 434.456 g/mol
SMILES c1([n+](onc1-c1ccccc1)[O-])CN1CCN(Cc2[n+](onc2-c2ccccc2)[O-])CC1
SPLASH splash10-014i-0940600000-0fac830d17c5c96c150b
Source of Spectrum D8-333-391-7
Wiley ID 1516891