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5,6-bis[p-(t-Butyl)phenyl]-4-cyanopyridazin-3(2H)-one
SpectraBase Compound ID F4yZI1eFJab
InChI InChI=1S/C25H27N3O/c1-24(2,3)18-11-7-16(8-12-18)21-20(15-26)23(29)28-27-22(21)17-9-13-19(14-10-17)25(4,5)6/h7-14H,1-6H3,(H,28,29)
InChIKey VXZYWEZSWXPZFJ-UHFFFAOYSA-N
Mol Weight 385.51 g/mol
Molecular Formula C25H27N3O
Exact Mass 385.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQK79x3YsyK
Name 5,6-bis[p-(t-Butyl)phenyl]-4-cyanopyridazin-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27N3O
InChI InChI=1S/C25H27N3O/c1-24(2,3)18-11-7-16(8-12-18)21-20(15-26)23(29)28-27-22(21)17-9-13-19(14-10-17)25(4,5)6/h7-14H,1-6H3,(H,28,29)
InChIKey VXZYWEZSWXPZFJ-UHFFFAOYSA-N
Molecular Weight 385.511 g/mol
SMILES N1C(C(=C(C(=N1)c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)C#N)=O
SPLASH splash10-00di-1009000000-cdacf404d2767bb504b5
Source of Spectrum AF-48-6849-5d
Synonyms 3,4-bis(4-tert-butylphenyl)-6-oxo-1H-pyridazine-5-carbonitrile 3,4-bis(4-tert-butylphenyl)-6-oxidanylidene-1H-pyridazine-5-carbonitrile
Wiley ID 1694025