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3(2H)-Pyridazinone, 4-bromo-5-[4-(3-fluorobenzoyl)-1-piperazinyl]-2-phenyl-
SpectraBase Compound ID FEt1afk4HuA
InChI InChI=1S/C21H18BrFN4O2/c22-19-18(14-24-27(21(19)29)17-7-2-1-3-8-17)25-9-11-26(12-10-25)20(28)15-5-4-6-16(23)13-15/h1-8,13-14H,9-12H2
InChIKey HEYDUZWHWDWICL-UHFFFAOYSA-N
Mol Weight 457.3 g/mol
Molecular Formula C21H18BrFN4O2
Exact Mass 456.059717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Cq7lqjNbQk
Name 3(2H)-Pyridazinone, 4-bromo-5-[4-(3-fluorobenzoyl)-1-piperazinyl]-2-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18BrFN4O2
InChI InChI=1S/C21H18BrFN4O2/c22-19-18(14-24-27(21(19)29)17-7-2-1-3-8-17)25-9-11-26(12-10-25)20(28)15-5-4-6-16(23)13-15/h1-8,13-14H,9-12H2
InChIKey HEYDUZWHWDWICL-UHFFFAOYSA-N
Molecular Weight 457.303 g/mol
SMILES c1cccc(c1)N1N=CC(N2CCN(CC2)C(=O)c2cc(ccc2)F)=C(C1=O)Br
SPLASH splash10-00fr-9512000000-c863c1a0e8190087821c
Source of Spectrum IY-1-4630-8
Synonyms 4-Bromo-5-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-3-pyridazinone 4-Bromo-5-[4-(3-fluorobenzoyl)piperazin-1-yl]-2-phenylpyridazin-3-one 4-Bromo-5-[4-(3-fluorobenzoyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one 4-Bromanyl-5-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one
Wiley ID 1654291