| SpectraBase Compound ID | 9Ro4pTNQpwN |
|---|---|
| InChI | InChI=1S/C11H22OS/c1-4-6-7-9-13-11(8-5-2)10(3)12/h11H,4-9H2,1-3H3 |
| InChIKey | JLFCWMGUKMZBEZ-UHFFFAOYSA-N |
| Mol Weight | 202.36 g/mol |
| Molecular Formula | C11H22OS |
| Exact Mass | 202.139137 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FxOXbCX176t |
|---|---|
| Name | 3-n-pentylthio-2-hexanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H22OS |
| InChI | InChI=1S/C11H22OS/c1-4-6-7-9-13-11(8-5-2)10(3)12/h11H,4-9H2,1-3H3 |
| InChIKey | JLFCWMGUKMZBEZ-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 202.356 g/mol |
| SMILES | CC(C(CCC)SCCCCC)=O |
| SPLASH | splash10-0aor-8910000000-d8c4b23b695340ea7b0d |
| Source of Spectrum | JP2010100569A |
| Wiley ID | 1841950 |