| SpectraBase Compound ID | AHRq1QgPEqT |
|---|---|
| InChI | InChI=1S/C12H10N2O5/c1-19-7-2-3-9(15)6(4-7)5-8-10(16)13-12(18)14-11(8)17/h2-5,15H,1H3,(H2,13,14,16,17,18) |
| InChIKey | NBHZUUXGMHPVRR-UHFFFAOYSA-N |
| Mol Weight | 262.22 g/mol |
| Molecular Formula | C12H10N2O5 |
| Exact Mass | 262.058971 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | YLvudsr113 |
|---|---|
| Name | 5-(2-Hydroxy-5-methoxy-benzylidene)-pyrimidine-2,4,6-trione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.058971425 u |
| Formula | C12H10N2O5 |
| InChI | InChI=1S/C12H10N2O5/c1-19-7-2-3-9(15)6(4-7)5-8-10(16)13-12(18)14-11(8)17/h2-5,15H,1H3,(H2,13,14,16,17,18) |
| InChIKey | NBHZUUXGMHPVRR-UHFFFAOYSA-N |
| SMILES | C1(NC(C(C(N1)=O)=CC1=C(C=CC(=C1)OC)O)=O)=O |