| SpectraBase Compound ID | EKD3o8GHzAZ |
|---|---|
| InChI | InChI=1S/C5H8OS/c1-5(2)3-7-4(5)6/h3H2,1-2H3 |
| InChIKey | HXSJCQOCSRYBNR-UHFFFAOYSA-N |
| Mol Weight | 116.18 g/mol |
| Molecular Formula | C5H8OS |
| Exact Mass | 116.029586 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1F4vveDEaMq |
|---|---|
| Name | 3,3-Dimethyl-2-thietanone |
| CAS Registry Number | 16432-61-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8OS |
| InChI | InChI=1S/C5H8OS/c1-5(2)3-7-4(5)6/h3H2,1-2H3 |
| InChIKey | HXSJCQOCSRYBNR-UHFFFAOYSA-N |
| Molecular Weight | 116.178 g/mol |
| SMILES | C1(C(=O)SC1)(C)C |
| SPLASH | splash10-0a4i-9000000000-5a78309b8ddfa8a4f008 |
| Source of Spectrum | C-110-4651-15 |
| Synonyms | 3,3-Dimethylthietan-2-one |
| Wiley ID | 1125311 |