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6-Hydroxy-3-methyl-6-(p-nitrophenyl)-hexa-3,4-dien-2-one
SpectraBase Compound ID 1oa2rObvAXa
InChI InChI=1S/C13H13NO4/c1-9(10(2)15)3-8-13(16)11-4-6-12(7-5-11)14(17)18/h4-8,13,16H,1-2H3
InChIKey NLUXNEBWWRUXEK-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLc0WIboWIA
Name 6-Hydroxy-3-methyl-6-(p-nitrophenyl)-hexa-3,4-dien-2-one
Alternate Name(s) 6-Hydroxy-3-methyl-6-(4-nitrophenyl)hexa-3,4-dien-2-one 6-Hydroxy-3-methyl-6-(4-nitrophenyl)-2-hexa-3,4-dienone 3-Methyl-6-(4-nitrophenyl)-6-oxidanyl-hexa-3,4-dien-2-one
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Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-9(10(2)15)3-8-13(16)11-4-6-12(7-5-11)14(17)18/h4-8,13,16H,1-2H3
InChIKey NLUXNEBWWRUXEK-UHFFFAOYSA-N
Molecular Weight 247.250 g/mol
SMILES OC(C=C=C(C(=O)C)C)c1ccc(N(=O)=O)cc1
SPLASH splash10-0006-9700000000-d11e792c213cb7109801
Source of Spectrum F5-3-3693-6f
Wiley ID 1732561