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Phenyl 4-phenyl-2-imidazolyl ketone N-methyl-N-phenylsulfonylhydrazone
SpectraBase Compound ID 1spoIUHSNL8
InChI InChI=1S/C23H20N4O2S/c1-27(30(28,29)20-15-9-4-10-16-20)26-22(19-13-7-3-8-14-19)23-24-17-21(25-23)18-11-5-2-6-12-18/h2-17H,1H3,(H,24,25)/b26-22-
InChIKey AGFSGTGMJBJRBY-ROMGYVFFSA-N
Mol Weight 416.5 g/mol
Molecular Formula C23H20N4O2S
Exact Mass 416.130697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GIdD34yL7JH
Name Phenyl 4-phenyl-2-imidazolyl ketone N-methyl-N-phenylsulfonylhydrazone
Comments Computed using HOSE algorithm
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Exact Mass 416.130697072 u
Formula C23H20N4O2S
InChI InChI=1S/C23H20N4O2S/c1-27(30(28,29)20-15-9-4-10-16-20)26-22(19-13-7-3-8-14-19)23-24-17-21(25-23)18-11-5-2-6-12-18/h2-17H,1H3,(H,24,25)/b26-22-
InChIKey AGFSGTGMJBJRBY-ROMGYVFFSA-N
Molecular Weight 416.499 g/mol
SMILES C1(\C(=N/N(S(=O)(=O)C=2C=CC=CC2)C)C=2C=CC=CC2)=NC(C2=CC=CC=C2)=CN1