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(4Z)-4-[2-(4-chlorobenzyl)oxybenzylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one
SpectraBase Compound ID Ik3UZmIHCCc
InChI InChI=1S/C24H18ClN3O4/c1-16-22(24(29)27(26-16)20-10-12-21(13-11-20)28(30)31)14-18-4-2-3-5-23(18)32-15-17-6-8-19(25)9-7-17/h2-14H,15H2,1H3/b22-14-
InChIKey PVMKBTFVKIEXPW-HMAPJEAMSA-N
Mol Weight 447.88 g/mol
Molecular Formula C24H18ClN3O4
Exact Mass 447.098584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WAAZvcC2nq
Name (4Z)-4-[2-(4-chlorobenzyl)oxybenzylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one
Alternate Name(s) (4Z)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one (4Z)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-5-methyl-2-(4-nitrophenyl)-3-pyrazolone (4Z)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18ClN3O4
InChI InChI=1S/C24H18ClN3O4/c1-16-22(24(29)27(26-16)20-10-12-21(13-11-20)28(30)31)14-18-4-2-3-5-23(18)32-15-17-6-8-19(25)9-7-17/h2-14H,15H2,1H3/b22-14-
InChIKey PVMKBTFVKIEXPW-HMAPJEAMSA-N
Molecular Weight 447.878 g/mol
SMILES C1(\C(C(=NN1c1ccc(N(=O)=O)cc1)C)=C/c1c(OCc2ccc(cc2)Cl)cccc1)=O
SPLASH splash10-004i-2900000000-69d09326221521017371
Wiley ID 1437374