| SpectraBase Compound ID | 3pkwabc7AXU |
|---|---|
| InChI | InChI=1S/C8H14O2S/c1-3-4-5-10-8(11)6-7(2)9/h3-6H2,1-2H3 |
| InChIKey | ZBVPPGPWKXARQP-UHFFFAOYSA-N |
| Mol Weight | 174.26 g/mol |
| Molecular Formula | C8H14O2S |
| Exact Mass | 174.071451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9zWWaGTD93V |
|---|---|
| Name | n-Butyl acetothioacetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O2S |
| InChI | InChI=1S/C8H14O2S/c1-3-4-5-10-8(11)6-7(2)9/h3-6H2,1-2H3 |
| InChIKey | ZBVPPGPWKXARQP-UHFFFAOYSA-N |
| Molecular Weight | 174.258 g/mol |
| SMILES | C(CC(=O)C)(OCCCC)=S |
| SPLASH | splash10-000i-9000000000-288b381e30f2c9dcc975 |
| Source of Spectrum | JX-2015-6-5599 |
| Synonyms | O-butyl 3-oxobutanethioate |
| Wiley ID | 1729173 |