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3-(p-Methylphenyl)-1-phenyl-1-propanone 2,4-dinitrophenylhydrazone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-(p-Methylphenyl)-1-phenyl-1-propanone 2,4-dinitrophenylhydrazone
SpectraBase Compound ID C4PX4LLofMB
InChI InChI=1S/C22H20N4O4/c1-16-7-9-17(10-8-16)11-13-20(18-5-3-2-4-6-18)23-24-21-14-12-19(25(27)28)15-22(21)26(29)30/h2-10,12,14-15,24H,11,13H2,1H3/b23-20+
InChIKey REYVECMFIYIUIQ-BSYVCWPDSA-N
Mol Weight 404.43 g/mol
Molecular Formula C22H20N4O4
Exact Mass 404.148455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G0RmbaY2WvB
Name 3-(p-Methylphenyl)-1-phenyl-1-propanone 2,4-dinitrophenylhydrazone
Comments Computed using HOSE algorithm
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Exact Mass 404.148455136 u
Formula C22H20N4O4
InChI InChI=1S/C22H20N4O4/c1-16-7-9-17(10-8-16)11-13-20(18-5-3-2-4-6-18)23-24-21-14-12-19(25(27)28)15-22(21)26(29)30/h2-10,12,14-15,24H,11,13H2,1H3/b23-20+
InChIKey REYVECMFIYIUIQ-BSYVCWPDSA-N
Molecular Weight 404.426 g/mol
SMILES C1(N(=O)=O)=CC(N(=O)=O)=CC=C1N\N=C/(CCC=1C=CC(=CC1)C)C=1C=CC=CC1