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3-(4-nitro-1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2,6-piperidinedione
SpectraBase Compound ID J1r4Md1zrmS
InChI InChI=1S/C13H11N3O5/c17-11-5-4-10(12(18)14-11)15-6-8-7(13(15)19)2-1-3-9(8)16(20)21/h1-3,10H,4-6H2,(H,14,17,18)
InChIKey JKPJLYIGKKDZDT-UHFFFAOYSA-N
Mol Weight 289.25 g/mol
Molecular Formula C13H11N3O5
Exact Mass 289.06987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73krVs5Df7b
Name 3-(4-nitro-1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2,6-piperidinedione
Appearance White crystalline powder
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Formula C13H11N3O5
InChI InChI=1S/C13H11N3O5/c17-11-5-4-10(12(18)14-11)15-6-8-7(13(15)19)2-1-3-9(8)16(20)21/h1-3,10H,4-6H2,(H,14,17,18)
InChIKey JKPJLYIGKKDZDT-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
SMILES N1C(CCC(C1=O)N1C(c2c(c([N+](=O)[O-])ccc2)C1)=O)=O
SPLASH splash10-0080-7390000000-547e52e4ae6550933ca7
Source of Spectrum RU2730858C1
Wiley ID 1877280