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4-[(5-Hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyliden]-5-methyl-2-phenyl-pyrazol-3(2H)-one
SpectraBase Compound ID LpWZU1FE1RL
InChI InChI=1S/C21H18N4O2/c1-14-18(20(26)24(22-14)16-9-5-3-6-10-16)13-19-15(2)23-25(21(19)27)17-11-7-4-8-12-17/h3-13,26H,1-2H3
InChIKey PHCPNSHHXUOXSD-UHFFFAOYSA-N
Mol Weight 358.4 g/mol
Molecular Formula C21H18N4O2
Exact Mass 358.142976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLT6FH4LBeK
Name 4-[(5-Hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyliden]-5-methyl-2-phenyl-pyrazol-3(2H)-one
Alternate Name(s) 4-((5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N4O2
InChI InChI=1S/C21H18N4O2/c1-14-18(20(26)24(22-14)16-9-5-3-6-10-16)13-19-15(2)23-25(21(19)27)17-11-7-4-8-12-17/h3-13,26H,1-2H3
InChIKey PHCPNSHHXUOXSD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19893310407
Molecular Weight 358.401 g/mol
SMILES Oc1[n](nc(c1C=C1C(N(N=C1C)c1ccccc1)=O)C)-c1ccccc1
SPLASH splash10-0a4l-3209000000-96f68ea34c3b85993709
Source of Spectrum JF-331-589-5
Wiley ID 1791746