| SpectraBase Compound ID | M6uQxTqu7F |
|---|---|
| InChI | InChI=1S/C9H10OS/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) |
| InChIKey | JZLMLFCJWFMZMC-UHFFFAOYSA-N |
| Mol Weight | 166.24 g/mol |
| Molecular Formula | C9H10OS |
| Exact Mass | 166.045236 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 585UQ7sD2qR |
|---|---|
| Name | 3-Phenylpropanethioic S-acid |
| CAS Registry Number | 77078-54-7 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H10OS |
| InChI | InChI=1S/C9H10OS/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) |
| InChIKey | JZLMLFCJWFMZMC-UHFFFAOYSA-N |
| Molecular Weight | 166.238 g/mol |
| SMILES | SC(=O)CCc1ccccc1 |
| SPLASH | splash10-0a5c-4900000000-f0e25f507d560fe39c38 |
| Source of Spectrum | F-44-3510-0 |
| Synonyms | 3-Phenylthiopropionic acid |
| Wiley ID | 1162128 |