![(rac)-2-(4-Phenylbutan-2-ylthio)benzo[d]oxazole](/api/spectrum/8X3ErzgF52n/structure.png?h=300&w=458 "(rac)-2-(4-Phenylbutan-2-ylthio)benzo[d]oxazole")
| SpectraBase Compound ID | CqbxtelxUIE |
|---|---|
| InChI | InChI=1S/C17H17NOS/c1-13(11-12-14-7-3-2-4-8-14)20-17-18-15-9-5-6-10-16(15)19-17/h2-10,13H,11-12H2,1H3 |
| InChIKey | WCGILKYGTFHQIA-UHFFFAOYSA-N |
| Mol Weight | 283.39 g/mol |
| Molecular Formula | C17H17NOS |
| Exact Mass | 283.103085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8X3ErzgF52n |
|---|---|
| Name | (rac)-2-(4-Phenylbutan-2-ylthio)benzo[D]oxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.103085344 u |
| Formula | C17H17NOS |
| InChI | InChI=1S/C17H17NOS/c1-13(11-12-14-7-3-2-4-8-14)20-17-18-15-9-5-6-10-16(15)19-17/h2-10,13H,11-12H2,1H3 |
| InChIKey | WCGILKYGTFHQIA-UHFFFAOYSA-N |
| SMILES | C=1C=C(CCC(SC2=NC3=C(O2)C=CC=C3)C)C=CC1 |