| SpectraBase Compound ID | 8ASD4heMiEF |
|---|---|
| InChI | InChI=1S/C12H16OS/c1-3-7-12(10(2)13)14-11-8-5-4-6-9-11/h4-6,8-9,12H,3,7H2,1-2H3 |
| InChIKey | KSHOMMWJGYYIPD-UHFFFAOYSA-N |
| Mol Weight | 208.32 g/mol |
| Molecular Formula | C12H16OS |
| Exact Mass | 208.092186 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HWngeEIOCk5 |
|---|---|
| Name | 3-(Phenylthio)-2-hexanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16OS |
| InChI | InChI=1S/C12H16OS/c1-3-7-12(10(2)13)14-11-8-5-4-6-9-11/h4-6,8-9,12H,3,7H2,1-2H3 |
| InChIKey | KSHOMMWJGYYIPD-UHFFFAOYSA-N |
| Molecular Weight | 208.319 g/mol |
| SMILES | C(Sc1ccccc1)(C(=O)C)CCC |
| SPLASH | splash10-00di-0910000000-691373777e85cdb04a1a |
| Source of Spectrum | QF-48-1377-5 |
| Synonyms | 3-Phenylsulfanylhexan-2-one |
| Wiley ID | 833977 |