| SpectraBase Compound ID | J2yEfGIrl6w |
|---|---|
| InChI | InChI=1S/C7H14O2S/c1-3-6(10)5-7(8)9-4-2/h6,10H,3-5H2,1-2H3 |
| InChIKey | XBTISKAUQUYNRZ-UHFFFAOYSA-N |
| Mol Weight | 162.25 g/mol |
| Molecular Formula | C7H14O2S |
| Exact Mass | 162.071451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GqKCIuj57Ug |
|---|---|
| Name | 3-Mercaptopentanoic acid ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O2S |
| InChI | InChI=1S/C7H14O2S/c1-3-6(10)5-7(8)9-4-2/h6,10H,3-5H2,1-2H3 |
| InChIKey | XBTISKAUQUYNRZ-UHFFFAOYSA-N |
| Molecular Weight | 162.247 g/mol |
| SMILES | SC(CC(=O)OCC)CC |
| SPLASH | splash10-0a70-9300000000-d43461226f2af082ae67 |
| Source of Spectrum | QC-5-409-2 |
| Synonyms | 3-Mercaptovaleric acid ethyl ester Ethyl 3-sulfanylpentanoate |
| Wiley ID | 883480 |