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2-Ethoxy-1-methyl-2-oxoethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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2-Ethoxy-1-methyl-2-oxoethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 1B88eDpleuK
InChI InChI=1S/C17H19BrN2O5/c1-4-24-15(21)10(3)25-16(22)13-9(2)19-17(23)20-14(13)11-5-7-12(18)8-6-11/h5-8,10,14H,4H2,1-3H3,(H2,19,20,23)
InChIKey WQVFGGGSIKGMMS-UHFFFAOYSA-N
Mol Weight 411.25 g/mol
Molecular Formula C17H19BrN2O5
Exact Mass 410.047735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hl2cZgfoicw
Name 2-Ethoxy-1-methyl-2-oxoethyl 4-(4-bromophenyl)-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 410.047734715 u
Formula C17H19BrN2O5
InChI InChI=1S/C17H19BrN2O5/c1-4-24-15(21)10(3)25-16(22)13-9(2)19-17(23)20-14(13)11-5-7-12(18)8-6-11/h5-8,10,14H,4H2,1-3H3,(H2,19,20,23)
InChIKey WQVFGGGSIKGMMS-UHFFFAOYSA-N
Molecular Weight 411.252 g/mol
SMILES N1C(NC(C(C(OC(C(=O)OCC)C)=O)=C1C)C=1C=CC(=CC1)Br)=O