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Benzonitrile, 4-[(2,2-dinitropropyl)amino]-
SpectraBase Compound ID DhfpIX0s4w1
InChI InChI=1S/C10H10N4O4/c1-10(13(15)16,14(17)18)7-12-9-4-2-8(6-11)3-5-9/h2-5,12H,7H2,1H3
InChIKey RFDLUUKKJYJHLO-UHFFFAOYSA-N
Mol Weight 250.21 g/mol
Molecular Formula C10H10N4O4
Exact Mass 250.070205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYoILxkG3eS
Name Benzonitrile, 4-[(2,2-dinitropropyl)amino]-
Alternate Name(s) 4-((2,2-Dinitropropyl)amino)benzonitrile 4-[(2,2-Dinitropropyl)amino]benzonitrile 4-(2,2-Dinitropropylamino)benzenecarbonitrile
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Formula C10H10N4O4
InChI InChI=1S/C10H10N4O4/c1-10(13(15)16,14(17)18)7-12-9-4-2-8(6-11)3-5-9/h2-5,12H,7H2,1H3
InChIKey RFDLUUKKJYJHLO-UHFFFAOYSA-N
Molecular Weight 250.214 g/mol
SMILES N(CC(C)([N+]([O-])=O)[N+]([O-])=O)c1ccc(C#N)cc1
SPLASH splash10-053r-5900000000-f22f9f498d77bd879e3a
Source of Spectrum JX-2015-1-632
Wiley ID 1721430