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3H-pyrazol-3-one, 2,4-dihydro-4-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-5-(methoxymethyl)-2-phenyl-, (4Z)-

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3H-pyrazol-3-one, 2,4-dihydro-4-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-5-(methoxymethyl)-2-phenyl-, (4Z)-
SpectraBase Compound ID 5lCvTFyQu7q
InChI InChI=1S/C22H20N4O3/c1-15-18(21(27)25(23-15)16-9-5-3-6-10-16)13-19-20(14-29-2)24-26(22(19)28)17-11-7-4-8-12-17/h3-13,27H,14H2,1-2H3/b19-13-
InChIKey BLBJXRFPLLEOLV-UYRXBGFRSA-N
Mol Weight 388.43 g/mol
Molecular Formula C22H20N4O3
Exact Mass 388.153541 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 80r1wcwziuP
Name 3H-Pyrazol-3-one, 2,4-dihydro-4-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-5-(methoxymethyl)-2-phenyl-, (4Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.153540517 u
Formula C22H20N4O3
InChI InChI=1S/C22H20N4O3/c1-15-18(21(27)25(23-15)16-9-5-3-6-10-16)13-19-20(14-29-2)24-26(22(19)28)17-11-7-4-8-12-17/h3-13,27H,14H2,1-2H3/b19-13-
InChIKey BLBJXRFPLLEOLV-UYRXBGFRSA-N
Molecular Weight 388.427 g/mol
SMILES OC=1N(C2=CC=CC=C2)N=C(C1\C=C/1C(N(C2=CC=CC=C2)N=C1COC)=O)C