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4-methyl-1-(3-nitroanilino)-1-phenyl-3-pentanone
SpectraBase Compound ID 9kR1u3qBT2H
InChI InChI=1S/C18H20N2O3/c1-13(2)18(21)12-17(14-7-4-3-5-8-14)19-15-9-6-10-16(11-15)20(22)23/h3-11,13,17,19H,12H2,1-2H3
InChIKey GYRPGJXKYNZBBO-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C18H20N2O3
Exact Mass 312.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDqJItgRkV9
Name 4-methyl-1-(3-nitroanilino)-1-phenyl-3-pentanone
Comments Less than 3 mono-isotopic peaks
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Formula C18H20N2O3
InChI InChI=1S/C18H20N2O3/c1-13(2)18(21)12-17(14-7-4-3-5-8-14)19-15-9-6-10-16(11-15)20(22)23/h3-11,13,17,19H,12H2,1-2H3
InChIKey GYRPGJXKYNZBBO-UHFFFAOYSA-N
Molecular Weight 312.369 g/mol
SMILES N(C(CC(=O)C(C)C)c1ccccc1)c1cc(N(=O)=O)ccc1
SPLASH splash10-004i-0092000000-5fb800a2aa9f6e14f5c1
Source of Spectrum OP-26-620-4
Synonyms 4-methyl-1-(3-nitroanilino)-1-phenyl-pentan-3-one 4-methyl-1-[(3-nitrophenyl)amino]-1-phenyl-pentan-3-one
Wiley ID 850692