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5-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione

View entire compound with spectra: 2 NMR

5-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID Hi6eDVKnCoZ
InChI InChI=1S/C18H18N4O3/c1-11-14(12(2)22(19-11)13-8-6-5-7-9-13)10-15-16(23)20(3)18(25)21(4)17(15)24/h5-10H,1-4H3
InChIKey ITIKYKBOLFWNIL-UHFFFAOYSA-N
Mol Weight 338.37 g/mol
Molecular Formula C18H18N4O3
Exact Mass 338.13789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28M3hv0fMIP
Name 5-[(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.137890453 u
Formula C18H18N4O3
InChI InChI=1S/C18H18N4O3/c1-11-14(12(2)22(19-11)13-8-6-5-7-9-13)10-15-16(23)20(3)18(25)21(4)17(15)24/h5-10H,1-4H3
InChIKey ITIKYKBOLFWNIL-UHFFFAOYSA-N
Molecular Weight 338.367 g/mol
SMILES C1(C(N(C)C(N(C1=O)C)=O)=O)=CC1=C(N(C=2C=CC=CC2)N=C1C)C