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3-Benzoylacrylic acid, (2,4-dinitrophenyl)hydrazone
SpectraBase Compound ID Uz7ly27APC
InChI InChI=1S/C16H12N4O6/c21-16(22)9-8-13(11-4-2-1-3-5-11)17-18-14-7-6-12(19(23)24)10-15(14)20(25)26/h1-10,18H,(H,21,22)
InChIKey SJHUUWUWTUBPJX-UHFFFAOYSA-N
Mol Weight 356.29 g/mol
Molecular Formula C16H12N4O6
Exact Mass 356.075684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrZVV98lUfH
Name 3-Benzoylacrylic acid, (2,4-dinitrophenyl)hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 356.075684116 u
Formula C16H12N4O6
InChI InChI=1S/C16H12N4O6/c21-16(22)9-8-13(11-4-2-1-3-5-11)17-18-14-7-6-12(19(23)24)10-15(14)20(25)26/h1-10,18H,(H,21,22)
InChIKey SJHUUWUWTUBPJX-UHFFFAOYSA-N
Molecular Weight 356.294 g/mol
SMILES OC(C=CC(=NNC1=C(C=C(C=C1)N(=O)=O)N(=O)=O)C1=CC=CC=C1)=O