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4-[p-(Diethylamino)phenylimino]-1,3-diphenyl-2-pyrazolin-5-one
SpectraBase Compound ID 86slkEFtovt
InChI InChI=1S/C25H24N4O/c1-3-28(4-2)21-17-15-20(16-18-21)26-24-23(19-11-7-5-8-12-19)27-29(25(24)30)22-13-9-6-10-14-22/h5-18H,3-4H2,1-2H3/b26-24+
InChIKey MXELMTWUFGWKPA-SHHOIMCASA-N
Mol Weight 396.49 g/mol
Molecular Formula C25H24N4O
Exact Mass 396.195011 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7XksXL8H10
Name 4-[p-(Diethylamino)phenylimino]-1,3-diphenyl-2-pyrazolin-5-one
Comments Computed using HOSE algorithm
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Exact Mass 396.195011408 u
Formula C25H24N4O
InChI InChI=1S/C25H24N4O/c1-3-28(4-2)21-17-15-20(16-18-21)26-24-23(19-11-7-5-8-12-19)27-29(25(24)30)22-13-9-6-10-14-22/h5-18H,3-4H2,1-2H3/b26-24+
InChIKey MXELMTWUFGWKPA-SHHOIMCASA-N
Molecular Weight 396.494 g/mol
SMILES C=1C(=CC=CC1)C=1\C(C(N(N1)C=1C=CC=CC1)=O)=N/C=1C=CC(=CC1)N(CC)CC