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3-Acetyl-1,3-dimethyl-5-nitroindolin-2-one
SpectraBase Compound ID 9kuuk8tnBR0
InChI InChI=1S/C12H12N2O4/c1-7(15)12(2)9-6-8(14(17)18)4-5-10(9)13(3)11(12)16/h4-6H,1-3H3
InChIKey DKHDOBQQGOJEIV-UHFFFAOYSA-N
Mol Weight 248.24 g/mol
Molecular Formula C12H12N2O4
Exact Mass 248.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n1dAFKKnKn
Name 3-Acetyl-1,3-dimethyl-5-nitroindolin-2-one
Alternate Name(s) 3-Acetyl-1,3-dimethyl-5-nitro-2-indolone 3-Acetyl-1,3-dimethyl-5-nitroindol-2-one 3-Acetyl-1,3-dimethyl-5-nitro-indolin-2-one 3-Ethanoyl-1,3-dimethyl-5-nitro-indol-2-one
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Formula C12H12N2O4
InChI InChI=1S/C12H12N2O4/c1-7(15)12(2)9-6-8(14(17)18)4-5-10(9)13(3)11(12)16/h4-6H,1-3H3
InChIKey DKHDOBQQGOJEIV-UHFFFAOYSA-N
Molecular Weight 248.238 g/mol
SMILES C1(C(N(C)c2c1cc(N(=O)=O)cc2)=O)(C(=O)C)C
SPLASH splash10-0a4i-1690000000-279b8a4ddadb7d6684f6
Source of Spectrum U1-2012-6609-2e
Wiley ID 1735612