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2-Propen-1-one, 1-(4-chlorophenyl)-3-phenyl-, (2,4-dinitrophenyl)hydrazone
SpectraBase Compound ID BAOeRFgOeCu
InChI InChI=1S/C21H15ClN4O4/c22-17-9-6-15(7-10-17)8-12-19(16-4-2-1-3-5-16)23-24-20-13-11-18(25(27)28)14-21(20)26(29)30/h1-14,24H/b12-8+,23-19+
InChIKey MFLINCVWOFRKKP-RBVKJLALSA-N
Mol Weight 422.83 g/mol
Molecular Formula C21H15ClN4O4
Exact Mass 422.078183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJ5fbSUjAiM
Name 2-Propen-1-one, 1-(4-chlorophenyl)-3-phenyl-, (2,4-dinitrophenyl)hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 422.078182675 u
Formula C21H15ClN4O4
InChI InChI=1S/C21H15ClN4O4/c22-17-9-6-15(7-10-17)8-12-19(16-4-2-1-3-5-16)23-24-20-13-11-18(25(27)28)14-21(20)26(29)30/h1-14,24H/b12-8+,23-19+
InChIKey MFLINCVWOFRKKP-RBVKJLALSA-N
Molecular Weight 422.828 g/mol
SMILES C1(N(=O)=O)=CC(N(=O)=O)=CC=C1N\N=C/(\C=C\C1=CC=C(C=C1)Cl)C1=CC=CC=C1