| SpectraBase Compound ID | L1bv158Hoh7 |
|---|---|
| InChI | InChI=1S/C10H12O2S/c1-8(10(11)12-2)13-9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey | QRANRVOUOAPAEV-UHFFFAOYSA-N |
| Mol Weight | 196.26 g/mol |
| Molecular Formula | C10H12O2S |
| Exact Mass | 196.055801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CwHQopwiUGK |
|---|---|
| Name | 2-(Phenylthio)propanoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H12O2S |
| InChI | InChI=1S/C10H12O2S/c1-8(10(11)12-2)13-9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey | QRANRVOUOAPAEV-UHFFFAOYSA-N |
| Molecular Weight | 196.264 g/mol |
| SMILES | C(C(C)Sc1ccccc1)(=O)OC |
| SPLASH | splash10-000i-0900000000-4c94702b948ce0fd48e0 |
| Source of Spectrum | KD-16-2588-10 |
| Synonyms | 2-(Phenylthio)propionic acid methyl ester |
| Wiley ID | 1637901 |