| SpectraBase Compound ID | FKho8hTZPz5 |
|---|---|
| InChI | InChI=1S/C9H16O2S/c1-4-5-6-9(7(2)10)12-8(3)11/h9H,4-6H2,1-3H3 |
| InChIKey | UWURWXLEPCAZRD-UHFFFAOYSA-N |
| Mol Weight | 188.28 g/mol |
| Molecular Formula | C9H16O2S |
| Exact Mass | 188.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9Ap6UDxytRl |
|---|---|
| Name | 3-acetylthio-2-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O2S |
| InChI | InChI=1S/C9H16O2S/c1-4-5-6-9(7(2)10)12-8(3)11/h9H,4-6H2,1-3H3 |
| InChIKey | UWURWXLEPCAZRD-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 188.285 g/mol |
| SMILES | C(C)(=O)SC(C(C)=O)CCCC |
| SPLASH | splash10-0f6x-9800000000-950691d7684fa79974b6 |
| Source of Spectrum | JP2010100570A |
| Wiley ID | 1841977 |