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2-{5-(4-methoxyphenyl)-1-[(2E)-3-phenyl-2-propenoyl]-4,5-dihydro-1H-pyrazol-3-yl}phenol
SpectraBase Compound ID JiSVkZj6c4f
InChI InChI=1S/C25H22N2O3/c1-30-20-14-12-19(13-15-20)23-17-22(21-9-5-6-10-24(21)28)26-27(23)25(29)16-11-18-7-3-2-4-8-18/h2-16,23,28H,17H2,1H3/b16-11+
InChIKey GGFNVLXOKBHUQT-LFIBNONCSA-N
Mol Weight 398.46 g/mol
Molecular Formula C25H22N2O3
Exact Mass 398.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9E0PNmCSOl0
Name 2-{5-(4-Methoxyphenyl)-1-[(2E)-3-phenyl-2-propenoyl]-4,5-dihydro-1H-pyrazol-3-yl}phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.163042573 u
Formula C25H22N2O3
InChI InChI=1S/C25H22N2O3/c1-30-20-14-12-19(13-15-20)23-17-22(21-9-5-6-10-24(21)28)26-27(23)25(29)16-11-18-7-3-2-4-8-18/h2-16,23,28H,17H2,1H3/b16-11+
InChIKey GGFNVLXOKBHUQT-LFIBNONCSA-N
Molecular Weight 398.462 g/mol
SMILES OC=1C(C2=NN(C(C2)C=2C=CC(=CC2)OC)C(\C=C\C2=CC=CC=C2)=O)=CC=CC1