| SpectraBase Compound ID | 1yzxSJCKDcP |
|---|---|
| InChI | InChI=1S/C20H22N2O2S/c1-15-13-19(22-20(23)21-15)25-12-6-2-5-11-24-18-10-9-16-7-3-4-8-17(16)14-18/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,21,22,23) |
| InChIKey | PPGDSYRNUKABGX-UHFFFAOYSA-N |
| Mol Weight | 354.47 g/mol |
| Molecular Formula | C20H22N2O2S |
| Exact Mass | 354.140199 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 | C84CBiMuPq0 |
|---|---|
| Name | 4-(5-(2-Naphthoxy)pentylthio)-6-methyl-uracil |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.140199128 u |
| Formula | C20H22N2O2S |
| InChI | InChI=1S/C20H22N2O2S/c1-15-13-19(22-20(23)21-15)25-12-6-2-5-11-24-18-10-9-16-7-3-4-8-17(16)14-18/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,21,22,23) |
| InChIKey | PPGDSYRNUKABGX-UHFFFAOYSA-N |
| Molecular Weight | 354.468 g/mol |
| SMILES | C1(N=C(C=C(N1)C)SCCCCCOC1=CC2=C(C=CC=C2)C=C1)=O |