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(4Z)-4-[4-(2-fluorobenzyl)oxy-3,5-dimethoxy-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone
SpectraBase Compound ID 1Lpc0ZhWSWT
InChI InChI=1S/C25H21FN2O5/c1-31-21-13-16(12-19-24(29)27-28(25(19)30)18-9-4-3-5-10-18)14-22(32-2)23(21)33-15-17-8-6-7-11-20(17)26/h3-14H,15H2,1-2H3,(H,27,29)/b19-12-
InChIKey UHHVSPAKYQQAPS-UNOMPAQXSA-N
Mol Weight 448.45 g/mol
Molecular Formula C25H21FN2O5
Exact Mass 448.14345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZgzGGRG1s9
Name (4Z)-4-[4-(2-fluorobenzyl)oxy-3,5-dimethoxy-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone
Alternate Name(s) (4Z)-4-[[4-[(2-fluorophenyl)methoxy]-3,5-dimethoxy-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione (4Z)-4-[[4-[(2-fluorophenyl)methoxy]-3,5-dimethoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione 4-{4-[(2-fluorobenzyl)oxy]-3,5-dimethoxybenzylidene}-1-phenyl-3,5-pyrazolidinedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21FN2O5
InChI InChI=1S/C25H21FN2O5/c1-31-21-13-16(12-19-24(29)27-28(25(19)30)18-9-4-3-5-10-18)14-22(32-2)23(21)33-15-17-8-6-7-11-20(17)26/h3-14H,15H2,1-2H3,(H,27,29)/b19-12-
InChIKey UHHVSPAKYQQAPS-UNOMPAQXSA-N
Molecular Weight 448.450 g/mol
SMILES N1N(C(\C(C1=O)=C\c1cc(OC)c(c(c1)OC)OCc1c(F)cccc1)=O)c1ccccc1
SPLASH splash10-0a4i-1911000000-1e02876ed8335175102c
Wiley ID 1464138