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3,6-Dimethyl-5-[2-(4-methyl-1-piperazinyl)ethyl]-4-oxido-1,2,4-triazin-4-ium
SpectraBase Compound ID 5AfbS1yaPxu
InChI InChI=1S/C12H21N5O/c1-10-12(17(18)11(2)14-13-10)4-5-16-8-6-15(3)7-9-16/h4-9H2,1-3H3
InChIKey XSTATJDWPMZDMN-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C12H21N5O
Exact Mass 251.17461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlxWL83e7ii
Name 3,6-Dimethyl-5-[2-(4-methyl-1-piperazinyl)ethyl]-4-oxido-1,2,4-triazin-4-ium
Alternate Name(s) 3,6-Dimethyl-5-[2-(4-methylpiperazine-1-yl)ethyl]-1,2,4-triazine N4-oxide 3,6-Dimethyl-5-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxidanidyl-1,2,4-triazin-4-ium 3,6-Dimethyl-5-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxido-1,2,4-triazin-4-ium 3,6-Dimethyl-5-[2-(4-methylpiperazino)ethyl]-4-oxido-1,2,4-triazin-4-ium 3,6-Dimethyl-5-(2-(4-methylpiperazin-1-yl)ethyl)-1,2,4-triazine 4-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C12H21N5O
InChI InChI=1S/C12H21N5O/c1-10-12(17(18)11(2)14-13-10)4-5-16-8-6-15(3)7-9-16/h4-9H2,1-3H3
InChIKey XSTATJDWPMZDMN-UHFFFAOYSA-N
Molecular Weight 251.334 g/mol
SMILES c1([n+](c(nnc1C)C)[O-])CCN1CCN(CC1)C
SPLASH splash10-03di-0910000000-1632c3fb400f713aa06b
Source of Spectrum D8-337-256-9
Wiley ID 1551256