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1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione, 5-(4-methoxyphenyl)-6-phenyl-

View entire compound with spectra: 2 NMR

1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione, 5-(4-methoxyphenyl)-6-phenyl-
SpectraBase Compound ID DzwY3ZOt4O0
InChI InChI=1S/C19H15N3O3/c1-25-13-9-7-11(8-10-13)14-15-17(21-19(24)22-18(15)23)20-16(14)12-5-3-2-4-6-12/h2-10H,1H3,(H3,20,21,22,23,24)
InChIKey GWHYQRIWNUDUOR-UHFFFAOYSA-N
Mol Weight 333.35 g/mol
Molecular Formula C19H15N3O3
Exact Mass 333.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9BdOB4WkQu7
Name 1H-Pyrrolo[2,3-D]pyrimidine-2,4(3H,7H)-dione, 5-(4-methoxyphenyl)-6-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.111341352 u
Formula C19H15N3O3
InChI InChI=1S/C19H15N3O3/c1-25-13-9-7-11(8-10-13)14-15-17(21-19(24)22-18(15)23)20-16(14)12-5-3-2-4-6-12/h2-10H,1H3,(H3,20,21,22,23,24)
InChIKey GWHYQRIWNUDUOR-UHFFFAOYSA-N
SMILES N1C(=C(C2=C1NC(NC2=O)=O)C=1C=CC(=CC1)OC)C=1C=CC=CC1