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2-Pyrazolin-5-one, 4-[[p-(dimethylamino)phenyl]imino]-1-(p-fluorophenyl)-3-methyl-
SpectraBase Compound ID 84zdSC6CINg
InChI InChI=1S/C18H17FN4O/c1-12-17(20-14-6-10-15(11-7-14)22(2)3)18(24)23(21-12)16-8-4-13(19)5-9-16/h4-11H,1-3H3/b20-17+
InChIKey GEAYCZXVSWXJRP-LVZFUZTISA-N
Mol Weight 324.36 g/mol
Molecular Formula C18H17FN4O
Exact Mass 324.138639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJUTtxVTxl9
Name 2-Pyrazolin-5-one, 4-[[p-(dimethylamino)phenyl]imino]-1-(p-fluorophenyl)-3-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.138639345 u
Formula C18H17FN4O
InChI InChI=1S/C18H17FN4O/c1-12-17(20-14-6-10-15(11-7-14)22(2)3)18(24)23(21-12)16-8-4-13(19)5-9-16/h4-11H,1-3H3/b20-17+
InChIKey GEAYCZXVSWXJRP-LVZFUZTISA-N
Molecular Weight 324.359 g/mol
SMILES C1(=O)N(N=C(\C1=N\C1=CC=C(C=C1)N(C)C)C)C1=CC=C(C=C1)F