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5-Hexyl-7-(hexylamino)-8-nitro-5,10-dihydropyrazino[2,3-b]quinoxaline-2,3-dicarbonitrile
SpectraBase Compound ID 61n7YLXMfJV
InChI InChI=1S/C24H30N8O2/c1-3-5-7-9-11-27-17-13-21-18(14-22(17)32(33)34)28-23-24(31(21)12-10-8-6-4-2)30-20(16-26)19(15-25)29-23/h13-14,27H,3-12H2,1-2H3,(H,28,29)
InChIKey QPBREVDSXBVHSY-UHFFFAOYSA-N
Mol Weight 462.56 g/mol
Molecular Formula C24H30N8O2
Exact Mass 462.249172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnCNpO7jujb
Name 5-Hexyl-7-(hexylamino)-8-nitro-5,10-dihydropyrazino[2,3-b]quinoxaline-2,3-dicarbonitrile
Appearance Dark red plates
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Exact Mass 462.249172236 u
Formula C24H30N8O2
InChI InChI=1S/C24H30N8O2/c1-3-5-7-9-11-27-17-13-21-18(14-22(17)32(33)34)28-23-24(31(21)12-10-8-6-4-2)30-20(16-26)19(15-25)29-23/h13-14,27H,3-12H2,1-2H3,(H,28,29)
InChIKey QPBREVDSXBVHSY-UHFFFAOYSA-N
Instrument Name Finnigan MAT SSQ 710
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500230
Molecular Weight 462.558 g/mol
Quality 111
SMILES N1C2=C(C=C(C(=C2)[N+](=O)[O-])NCCCCCC)N(CCCCCC)C2=C1N=C(C(=N2)C#N)C#N
SPLASH splash10-03dl-7070900000-37056a1f2100bb88e7dd
Source of Spectrum QE-21-SM14-17c (DOI: 10.1002/chem.201500230)
Wiley ID 1909095