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2-(3-Aminophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carbonitrile
SpectraBase Compound ID 6IisEMOjEyx
InChI InChI=1S/C13H12N2O2/c1-13(2)12(16)10(7-14)11(17-13)8-4-3-5-9(15)6-8/h3-6H,15H2,1-2H3
InChIKey OEULDDVWDQDLAW-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqcyKOgu30r
Name 2-(3-Aminophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carbonitrile
Appearance Yellow powder
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Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-13(2)12(16)10(7-14)11(17-13)8-4-3-5-9(15)6-8/h3-6H,15H2,1-2H3
InChIKey OEULDDVWDQDLAW-UHFFFAOYSA-N
Instrument Name Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.827
Molecular Weight 228.251 g/mol
SMILES Nc1cc(C=2OC(C(C2C#N)=O)(C)C)ccc1
SPLASH splash10-002f-1950000000-be84298471189116549d
Source of Spectrum ARK-2012-323-2a
Wiley ID 1864805