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4-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
SpectraBase Compound ID 2nVq1KGQytM
InChI InChI=1S/C20H14N2O4/c1-12-16(20(25)22(21-12)14-5-3-2-4-6-14)9-13-11-26-18-8-7-15(23)10-17(18)19(13)24/h2-11,23H,1H3
InChIKey LUPSGNMPIVHDSN-UHFFFAOYSA-N
Mol Weight 346.34 g/mol
Molecular Formula C20H14N2O4
Exact Mass 346.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQJTVsMKM7D
Name 4-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N2O4
InChI InChI=1S/C20H14N2O4/c1-12-16(20(25)22(21-12)14-5-3-2-4-6-14)9-13-11-26-18-8-7-15(23)10-17(18)19(13)24/h2-11,23H,1H3
InChIKey LUPSGNMPIVHDSN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.20048
Molecular Weight 346.342 g/mol
SMILES Oc1cc2c(cc1)OC=C(C2=O)C=C1C(N(N=C1C)c1ccccc1)=O
SPLASH splash10-0002-0019000000-bb9a98fa1b20fc3c97d8
Source of Spectrum HAC-16-27-22
Synonyms 4-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Wiley ID 1783449