| SpectraBase Compound ID | 29COvYwaN1x |
|---|---|
| InChI | InChI=1S/C12H13NOS/c1-2-8-15-12-9-11(14-13-12)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3 |
| InChIKey | YMRZQKZGUSUZQT-UHFFFAOYSA-N |
| Mol Weight | 219.3 g/mol |
| Molecular Formula | C12H13NOS |
| Exact Mass | 219.071785 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2OAXPtgBypH |
|---|---|
| Name | 5-Phenyl-3-(propylthio)isoxazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NOS |
| InChI | InChI=1S/C12H13NOS/c1-2-8-15-12-9-11(14-13-12)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3 |
| InChIKey | YMRZQKZGUSUZQT-UHFFFAOYSA-N |
| Molecular Weight | 219.302 g/mol |
| SMILES | c1(noc(c1)-c1ccccc1)SCCC |
| SPLASH | splash10-0a4i-0910000000-a9821b65df5629c7ddc9 |
| Source of Spectrum | SO-0-22-4 |
| Synonyms | 5-Phenyl-3-propylsulfanyl-1,2-oxazole |
| Wiley ID | 1540423 |