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Acetic acid [5-(4-benzoylamino-2-oxo-2H-pyrimidin-1-yl)-2-hydroxymethyltetrahydrofuran-3-yl] ester
SpectraBase Compound ID 6ZNKLdjLgEa
InChI InChI=1S/C18H19N3O6/c1-11(23)26-13-9-16(27-14(13)10-22)21-8-7-15(20-18(21)25)19-17(24)12-5-3-2-4-6-12/h2-8,13-14,16,22H,9-10H2,1H3,(H,19,20,24,25)
InChIKey YHQCWFGKRPKMDG-UHFFFAOYSA-N
Mol Weight 373.37 g/mol
Molecular Formula C18H19N3O6
Exact Mass 373.127385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J31TfdoyIN2
Name Acetic acid [5-(4-benzoylamino-2-oxo-2H-pyrimidin-1-yl)-2-hydroxymethyltetrahydrofuran-3-yl] ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.127385338 u
Formula C18H19N3O6
InChI InChI=1S/C18H19N3O6/c1-11(23)26-13-9-16(27-14(13)10-22)21-8-7-15(20-18(21)25)19-17(24)12-5-3-2-4-6-12/h2-8,13-14,16,22H,9-10H2,1H3,(H,19,20,24,25)
InChIKey YHQCWFGKRPKMDG-UHFFFAOYSA-N
Molecular Weight 373.365 g/mol
SMILES C1(CC(N2C(=O)N=C(C=C2)NC(=O)C2=CC=CC=C2)OC1CO)OC(C)=O