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1,5-dimethyl-4-[(2-oxo-2H-chromen-4-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID D9PZaPrDuSS
InChI InChI=1S/C20H17N3O3/c1-13-19(20(25)23(22(13)2)14-8-4-3-5-9-14)21-16-12-18(24)26-17-11-7-6-10-15(16)17/h3-12,21H,1-2H3
InChIKey ZIGWZRGTVKCYGF-UHFFFAOYSA-N
Mol Weight 347.37 g/mol
Molecular Formula C20H17N3O3
Exact Mass 347.126991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4BZupIypLt
Name 1,5-Dimethyl-4-[(2-oxo-2H-chromen-4-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.126991416 u
Formula C20H17N3O3
InChI InChI=1S/C20H17N3O3/c1-13-19(20(25)23(22(13)2)14-8-4-3-5-9-14)21-16-12-18(24)26-17-11-7-6-10-15(16)17/h3-12,21H,1-2H3
InChIKey ZIGWZRGTVKCYGF-UHFFFAOYSA-N
Molecular Weight 347.374 g/mol
SMILES N(C=1C2=CC=CC=C2OC(=O)C1)C1=C(N(N(C1=O)C1=CC=CC=C1)C)C