![1-[3-Hydroxypropoxy(phenyl)methyl]pyrimidine-2,4-dione](/api/spectrum/9pmtqqsyHfz/structure.png?h=300&w=458 "1-[3-Hydroxypropoxy(phenyl)methyl]pyrimidine-2,4-dione")
| SpectraBase Compound ID | EDabpDzJwww |
|---|---|
| InChI | InChI=1S/C14H16N2O4/c17-9-4-10-20-13(11-5-2-1-3-6-11)16-8-7-12(18)15-14(16)19/h1-3,5-8,13,17H,4,9-10H2,(H,15,18,19) |
| InChIKey | SRRRFTRRQBQGEI-UHFFFAOYSA-N |
| Mol Weight | 276.29 g/mol |
| Molecular Formula | C14H16N2O4 |
| Exact Mass | 276.111007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9pmtqqsyHfz |
|---|---|
| Name | 1-[3-Hydroxypropoxy(phenyl)methyl]pyrimidine-2,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.111006999 u |
| Formula | C14H16N2O4 |
| InChI | InChI=1S/C14H16N2O4/c17-9-4-10-20-13(11-5-2-1-3-6-11)16-8-7-12(18)15-14(16)19/h1-3,5-8,13,17H,4,9-10H2,(H,15,18,19) |
| InChIKey | SRRRFTRRQBQGEI-UHFFFAOYSA-N |
| SMILES | C1(N(C=CC(N1)=O)C(C1=CC=CC=C1)OCCCO)=O |