| SpectraBase Compound ID | 35F1qx2Gmei |
|---|---|
| InChI | InChI=1S/C12H22O2S/c1-6-7-8-10(9(2)13)15-11(14)12(3,4)5/h10H,6-8H2,1-5H3 |
| InChIKey | JBUCOKCLLMXEFV-UHFFFAOYSA-N |
| Mol Weight | 230.37 g/mol |
| Molecular Formula | C12H22O2S |
| Exact Mass | 230.134051 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 67Bd9DZAG49 |
|---|---|
| Name | 3-pivaloylthio-2-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22O2S |
| InChI | InChI=1S/C12H22O2S/c1-6-7-8-10(9(2)13)15-11(14)12(3,4)5/h10H,6-8H2,1-5H3 |
| InChIKey | JBUCOKCLLMXEFV-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 230.366 g/mol |
| SMILES | CC(C(CCCC)SC(C(C)(C)C)=O)=O |
| SPLASH | splash10-0a4u-9300000000-0f45de35e4110a2ee22e |
| Source of Spectrum | JP2010100570A |
| Wiley ID | 1841980 |