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5-butyl-2-[4-(3-methoxyphenyl)-1-piperazinyl]-6-methyl-4(3H)-pyrimidinone

View entire compound with spectra: 2 NMR

5-butyl-2-[4-(3-methoxyphenyl)-1-piperazinyl]-6-methyl-4(3H)-pyrimidinone
SpectraBase Compound ID DSVfYYYwa4J
InChI InChI=1S/C20H28N4O2/c1-4-5-9-18-15(2)21-20(22-19(18)25)24-12-10-23(11-13-24)16-7-6-8-17(14-16)26-3/h6-8,14H,4-5,9-13H2,1-3H3,(H,21,22,25)
InChIKey GMFAINHCQMCJAP-UHFFFAOYSA-N
Mol Weight 356.47 g/mol
Molecular Formula C20H28N4O2
Exact Mass 356.221226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D75dLsuhVGA
Name 5-Butyl-2-[4-(3-methoxyphenyl)-1-piperazinyl]-6-methyl-4(3H)-pyrimidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.221226156 u
Formula C20H28N4O2
InChI InChI=1S/C20H28N4O2/c1-4-5-9-18-15(2)21-20(22-19(18)25)24-12-10-23(11-13-24)16-7-6-8-17(14-16)26-3/h6-8,14H,4-5,9-13H2,1-3H3,(H,21,22,25)
InChIKey GMFAINHCQMCJAP-UHFFFAOYSA-N
Molecular Weight 356.470 g/mol
SMILES N1C(C(=C(N=C1N1CCN(CC1)C1=CC(OC)=CC=C1)C)CCCC)=O