| SpectraBase Compound ID | CL0OiDIhMqe |
|---|---|
| InChI | InChI=1S/C10H18O2S/c1-4-5-6-7-10(8(2)11)13-9(3)12/h10H,4-7H2,1-3H3 |
| InChIKey | VHBIQCFYFUOLOL-UHFFFAOYSA-N |
| Mol Weight | 202.31 g/mol |
| Molecular Formula | C10H18O2S |
| Exact Mass | 202.102751 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EgtoSOcbCIJ |
|---|---|
| Name | 3-acetylthio-2-octanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H18O2S |
| InChI | InChI=1S/C10H18O2S/c1-4-5-6-7-10(8(2)11)13-9(3)12/h10H,4-7H2,1-3H3 |
| InChIKey | VHBIQCFYFUOLOL-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 202.312 g/mol |
| SMILES | CC(C(CCCCC)SC(=O)C)=O |
| SPLASH | splash10-00l6-9800000000-d3a69b09b5259d8e5917 |
| Source of Spectrum | JP2010100570A |
| Wiley ID | 1841983 |