| SpectraBase Compound ID | JCb2faC54nR |
|---|---|
| InChI | InChI=1S/C9H16O2S/c1-6(10)7(2)12-8(11)9(3,4)5/h7H,1-5H3 |
| InChIKey | DGRSBEQURDDUKV-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 | F91uHOkFlv7 |
|---|---|
| Name | 3-pivaloylthio-2-butanone |
| Appearance | Crude oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O2S |
| InChI | InChI=1S/C9H16O2S/c1-6(10)7(2)12-8(11)9(3,4)5/h7H,1-5H3 |
| InChIKey | DGRSBEQURDDUKV-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 188.285 g/mol |
| SMILES | CC(C(C)SC(C(C)(C)C)=O)=O |
| SPLASH | splash10-0a4i-9000000000-b9f4301b3f2f6afc5322 |
| Source of Spectrum | JP2010100570A |
| Wiley ID | 1841975 |