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Ethyl 4-[5-(2,5-dimethyl-4-nitrophenyl)-2-furyl]-1,2,3,4-tetrahydro-6-methyl-2-oxo-5-pyrimidinecarboxylate
SpectraBase Compound ID GRRAMDV4xVa
InChI InChI=1S/C20H21N3O6/c1-5-28-19(24)17-12(4)21-20(25)22-18(17)16-7-6-15(29-16)13-8-11(3)14(23(26)27)9-10(13)2/h6-9,18H,5H2,1-4H3,(H2,21,22,25)
InChIKey TXIBFEQAEATWDL-UHFFFAOYSA-N
Mol Weight 399.4 g/mol
Molecular Formula C20H21N3O6
Exact Mass 399.143035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WDXN3JO70U
Name Ethyl 4-[5-(2,5-dimethyl-4-nitrophenyl)-2-furyl]-1,2,3,4-tetrahydro-6-methyl-2-oxo-5-pyrimidinecarboxylate
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O6
InChI InChI=1S/C20H21N3O6/c1-5-28-19(24)17-12(4)21-20(25)22-18(17)16-7-6-15(29-16)13-8-11(3)14(23(26)27)9-10(13)2/h6-9,18H,5H2,1-4H3,(H2,21,22,25)
InChIKey TXIBFEQAEATWDL-UHFFFAOYSA-N
Molecular Weight 399.403 g/mol
SMILES N1C(=O)NC(=C(C1c1ccc(o1)-c1cc(c(cc1C)[N+]([O-])=O)C)C(OCC)=O)C
SPLASH splash10-00fu-5922000000-e11170d70415f5e87b7a
Synonyms Ethyl 4-[5-(2,5-dimethyl-4-nitrophenyl)-2-furyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate Ethyl 4-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Wiley ID 1467603