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4-(Acetylacetyl)-5-hydroxy-3-phenethyl-1-phenylpyrazole
SpectraBase Compound ID EgbjdUdR9wH
InChI InChI=1S/C21H20N2O3/c1-15(24)14-19(25)20-18(13-12-16-8-4-2-5-9-16)22-23(21(20)26)17-10-6-3-7-11-17/h2-11,26H,12-14H2,1H3
InChIKey HHYFVTJZJVGSQO-UHFFFAOYSA-N
Mol Weight 348.4 g/mol
Molecular Formula C21H20N2O3
Exact Mass 348.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F18NW49AE4S
Name 4-(Acetylacetyl)-5-hydroxy-3-phenethyl-1-phenylpyrazole
Alternate Name(s) 1-[5-hydroxy-1-phenyl-3-(2-phenylethyl)-1H-pyrazol-4-yl]-1,3-butanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O3
InChI InChI=1S/C21H20N2O3/c1-15(24)14-19(25)20-18(13-12-16-8-4-2-5-9-16)22-23(21(20)26)17-10-6-3-7-11-17/h2-11,26H,12-14H2,1H3
InChIKey HHYFVTJZJVGSQO-UHFFFAOYSA-N
Molecular Weight 348.402 g/mol
SMILES Oc1c(c(CCc2ccccc2)n[n]1-c1ccccc1)C(CC(=O)C)=O
SPLASH splash10-002g-9424000000-ea7d8b6cbbc8d4d69620
Source of Spectrum SK-21-1196-3
Wiley ID 851869