![2R,3S-1-[1,3,4-Trihydroxy-2-butoxymethyl]thymine](/api/spectrum/9ZhwfHB5hGl/structure.png?h=300&w=458 "2R,3S-1-[1,3,4-Trihydroxy-2-butoxymethyl]thymine")
| SpectraBase Compound ID | 1C3u4fMTCDu |
|---|---|
| InChI | InChI=1S/C10H16N2O6/c1-6-2-12(10(17)11-9(6)16)5-18-8(4-14)7(15)3-13/h2,7-8,13-15H,3-5H2,1H3,(H,11,16,17) |
| InChIKey | UOGGWSNXVOOVTA-UHFFFAOYSA-N |
| Mol Weight | 260.25 g/mol |
| Molecular Formula | C10H16N2O6 |
| Exact Mass | 260.100836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9ZhwfHB5hGl |
|---|---|
| Name | 2R,3S-1-[1,3,4-Trihydroxy-2-butoxymethyl]thymine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.100836237 u |
| Formula | C10H16N2O6 |
| InChI | InChI=1S/C10H16N2O6/c1-6-2-12(10(17)11-9(6)16)5-18-8(4-14)7(15)3-13/h2,7-8,13-15H,3-5H2,1H3,(H,11,16,17) |
| InChIKey | UOGGWSNXVOOVTA-UHFFFAOYSA-N |
| SMILES | C1(N(C=C(C(N1)=O)C)COC(C(CO)O)CO)=O |