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2-Methyl-4,5,9,10-tetraazapentacyclo[6.2.2.2(3,6).1(2,7).0(2,7)]tetradeca-4,9-diene-4,5,10-trioxide
SpectraBase Compound ID ubHxaNfkdd
InChI InChI=1S/C11H16N4O3/c1-11-8-4-2-6(13(16)12-8)10(11)7-3-5-9(11)15(18)14(7)17/h6-10H,2-5H2,1H3/t6-,7+,8+,9-,10+,11-/m1/s1
InChIKey NPBQKYPCCDUANQ-SKHVAJMDSA-N
Mol Weight 252.27 g/mol
Molecular Formula C11H16N4O3
Exact Mass 252.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9H6Wi3oABP
Name 2-Methyl-4,5,9,10-tetraazapentacyclo[6.2.2.2(3,6).1(2,7).0(2,7)]tetradeca-4,9-diene-4,5,10-trioxide
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Formula C11H16N4O3
InChI InChI=1S/C11H16N4O3/c1-11-8-4-2-6(13(16)12-8)10(11)7-3-5-9(11)15(18)14(7)17/h6-10H,2-5H2,1H3/t6-,7+,8+,9-,10+,11-/m1/s1
InChIKey NPBQKYPCCDUANQ-SKHVAJMDSA-N
Molecular Weight 252.274 g/mol
SMILES [C@@]12([N+](=[N+]([C@@]([C@]3([C@]4(N=[N+]([C@@]([C@@]23[H])(CC4)[H])[O-])[H])C)(CC1)[H])[O-])[O-])[H]
SPLASH splash10-0002-9830000000-875c14ee9c1cdd40bb0c
Source of Spectrum K1-2000-798-10
Wiley ID 749787