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6-Phenyl-3,5-hexadien-2-one, 2,4-dinitrophenylhydrazone
SpectraBase Compound ID HadExMlIDFY
InChI InChI=1S/C18H16N4O4/c1-14(7-5-6-10-15-8-3-2-4-9-15)19-20-17-12-11-16(21(23)24)13-18(17)22(25)26/h2-13,20H,1H3
InChIKey KSOJBZISZIOKHG-UHFFFAOYSA-N
Mol Weight 352.35 g/mol
Molecular Formula C18H16N4O4
Exact Mass 352.117155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8znKKmnEuda
Name 6-Phenyl-3,5-hexadien-2-one, 2,4-dinitrophenylhydrazone
Comments Computed using HOSE algorithm
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Exact Mass 352.117155007 u
Formula C18H16N4O4
InChI InChI=1S/C18H16N4O4/c1-14(7-5-6-10-15-8-3-2-4-9-15)19-20-17-12-11-16(21(23)24)13-18(17)22(25)26/h2-13,20H,1H3
InChIKey KSOJBZISZIOKHG-UHFFFAOYSA-N
Molecular Weight 352.350 g/mol
SMILES N(N=C(C=CC=CC=1C=CC=CC1)C)C=1C(=CC(=CC1)N(=O)=O)N(=O)=O