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4-Benzoyl-3-(2-benzyloxy-6-hydroxyphenyl)-5-phenylpyrazole
SpectraBase Compound ID 8sNicaG8k52
InChI InChI=1S/C29H22N2O3/c32-23-17-10-18-24(34-19-20-11-4-1-5-12-20)25(23)28-26(29(33)22-15-8-3-9-16-22)27(30-31-28)21-13-6-2-7-14-21/h1-18,32H,19H2,(H,30,31)
InChIKey DGFMEQSNUNKCRQ-UHFFFAOYSA-N
Mol Weight 446.51 g/mol
Molecular Formula C29H22N2O3
Exact Mass 446.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VRyi8DcdPL
Name 4-Benzoyl-3-(2-benzyloxy-6-hydroxyphenyl)-5-phenylpyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22N2O3
InChI InChI=1S/C29H22N2O3/c32-23-17-10-18-24(34-19-20-11-4-1-5-12-20)25(23)28-26(29(33)22-15-8-3-9-16-22)27(30-31-28)21-13-6-2-7-14-21/h1-18,32H,19H2,(H,30,31)
InChIKey DGFMEQSNUNKCRQ-UHFFFAOYSA-N
Molecular Weight 446.506 g/mol
SMILES [nH]1c(c(c(-c2c(cccc2OCc2ccccc2)O)n1)C(c1ccccc1)=O)-c1ccccc1
SPLASH splash10-052g-8605900000-701f1b2863bb0336f044
Source of Spectrum U1-2002-3813-6
Synonyms {3-[2-(benzyloxy)-6-hydroxyphenyl]-5-phenyl-1H-pyrazol-4-yl}(phenyl)methanone
Wiley ID 1523463