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4(1H)-Pyrimidinone, 6-methyl-2-[[3-(2-naphthalenyloxy)propyl]thio]-

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4(1H)-Pyrimidinone, 6-methyl-2-[[3-(2-naphthalenyloxy)propyl]thio]-
SpectraBase Compound ID 607gfmAqI72
InChI InChI=1S/C18H18N2O2S/c1-13-11-17(21)20-18(19-13)23-10-4-9-22-16-8-7-14-5-2-3-6-15(14)12-16/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,19,20,21)
InChIKey AWDYSIDEPLFDCB-UHFFFAOYSA-N
Mol Weight 326.41 g/mol
Molecular Formula C18H18N2O2S
Exact Mass 326.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4OpfUW7OJbx
Name 4(1H)-Pyrimidinone, 6-methyl-2-[[3-(2-naphthalenyloxy)propyl]thio]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.108899000 u
Formula C18H18N2O2S
InChI InChI=1S/C18H18N2O2S/c1-13-11-17(21)20-18(19-13)23-10-4-9-22-16-8-7-14-5-2-3-6-15(14)12-16/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,19,20,21)
InChIKey AWDYSIDEPLFDCB-UHFFFAOYSA-N
Molecular Weight 326.414 g/mol
SMILES C1(=NC(C=C(N1)C)=O)SCCCOC=1C=C2C=CC=CC2=CC1