| SpectraBase Compound ID | 5yYMvqsAztw |
|---|---|
| InChI | InChI=1S/C12H24O2S/c1-4-6-7-8-9-15-11(3)10-12(13)14-5-2/h11H,4-10H2,1-3H3 |
| InChIKey | MGAOREUOIBASMU-UHFFFAOYSA-N |
| Mol Weight | 232.38 g/mol |
| Molecular Formula | C12H24O2S |
| Exact Mass | 232.149701 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7sj2hJylw7P |
|---|---|
| Name | 3-(hexylthio)butanoic acid ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H24O2S |
| InChI | InChI=1S/C12H24O2S/c1-4-6-7-8-9-15-11(3)10-12(13)14-5-2/h11H,4-10H2,1-3H3 |
| InChIKey | MGAOREUOIBASMU-UHFFFAOYSA-N |
| Molecular Weight | 232.382 g/mol |
| SMILES | C(CC(SCCCCCC)C)(=O)OCC |
| SPLASH | splash10-0ldj-4900000000-dc3042680fa91738de68 |
| Source of Spectrum | SK-26-2194-0 |
| Synonyms | 3-(hexylthio)butyric acid ethyl ester |
| Wiley ID | 867185 |