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4-Methylbenzyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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4-Methylbenzyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 6DmrZZxMjMB
InChI InChI=1S/C20H19FN2O3/c1-12-3-5-14(6-4-12)11-26-19(24)17-13(2)22-20(25)23-18(17)15-7-9-16(21)10-8-15/h3-10,18H,11H2,1-2H3,(H2,22,23,25)
InChIKey YOLYHOAGRDFFGB-UHFFFAOYSA-N
Mol Weight 354.38 g/mol
Molecular Formula C20H19FN2O3
Exact Mass 354.137971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1ep3uP6Rjg
Name 4-Methylbenzyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.137970640 u
Formula C20H19FN2O3
InChI InChI=1S/C20H19FN2O3/c1-12-3-5-14(6-4-12)11-26-19(24)17-13(2)22-20(25)23-18(17)15-7-9-16(21)10-8-15/h3-10,18H,11H2,1-2H3,(H2,22,23,25)
InChIKey YOLYHOAGRDFFGB-UHFFFAOYSA-N
Molecular Weight 354.381 g/mol
SMILES N1C(=C(C(NC1=O)C=1C=CC(=CC1)F)C(=O)OCC1=CC=C(C=C1)C)C