| SpectraBase Compound ID | ILc7mlZeSgT |
|---|---|
| InChI | InChI=1S/C14H14N2O4/c1-8(2)20-11-6-4-3-5-9(11)7-10-12(17)15-14(19)16-13(10)18/h3-8H,1-2H3,(H2,15,16,17,18,19) |
| InChIKey | SSAMPGRBROHXCB-UHFFFAOYSA-N |
| Mol Weight | 274.28 g/mol |
| Molecular Formula | C14H14N2O4 |
| Exact Mass | 274.095357 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Crdl6lODyOD |
|---|---|
| Name | Pyrimidine-2,4,6-(1H,3H,5H)-trione, 5-(2-isopropoxybenzylidene)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.095356935 u |
| Formula | C14H14N2O4 |
| InChI | InChI=1S/C14H14N2O4/c1-8(2)20-11-6-4-3-5-9(11)7-10-12(17)15-14(19)16-13(10)18/h3-8H,1-2H3,(H2,15,16,17,18,19) |
| InChIKey | SSAMPGRBROHXCB-UHFFFAOYSA-N |
| SMILES | C1(C(NC(NC1=O)=O)=O)=CC1=CC=CC=C1OC(C)C |