![2-(2-hydroxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one](/api/spectrum/8ncyhEDVtKo/structure.png?h=300&w=458 "2-(2-hydroxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one")
| SpectraBase Compound ID | EDaaTHQePlH |
|---|---|
| InChI | InChI=1S/C14H12N2O2S/c1-7-8(2)19-14-11(7)13(18)15-12(16-14)9-5-3-4-6-10(9)17/h3-6,17H,1-2H3,(H,15,16,18) |
| InChIKey | LXLYAKGXDXRHNY-UHFFFAOYSA-N |
| Mol Weight | 272.32 g/mol |
| Molecular Formula | C14H12N2O2S |
| Exact Mass | 272.061949 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ncyhEDVtKo |
|---|---|
| Name | 2-(2-Hydroxyphenyl)-5,6-dimethylthieno[2,3-D]pyrimidin-4(3H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.061948806 u |
| Formula | C14H12N2O2S |
| InChI | InChI=1S/C14H12N2O2S/c1-7-8(2)19-14-11(7)13(18)15-12(16-14)9-5-3-4-6-10(9)17/h3-6,17H,1-2H3,(H,15,16,18) |
| InChIKey | LXLYAKGXDXRHNY-UHFFFAOYSA-N |
| Molecular Weight | 272.322 g/mol |
| SMILES | N1C(C2=C(N=C1C1=C(C=CC=C1)O)SC(=C2C)C)=O |