| SpectraBase Compound ID | 3u6JV24anzA |
|---|---|
| InChI | InChI=1S/C6H6O2S/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2,(H,7,8) |
| InChIKey | SMJRBWINMFUUDS-UHFFFAOYSA-N |
| Mol Weight | 142.17 g/mol |
| Molecular Formula | C6H6O2S |
| Exact Mass | 142.008851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L200pQFtvqa |
|---|---|
| Name | 2-THIOPHENEACETIC ACID |
| Source of Sample | Research Organic/Inorganic Chemical Corporation, Belleville, New Jersey |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6O2S |
| InChI | InChI=1S/C6H6O2S/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2,(H,7,8) |
| InChIKey | SMJRBWINMFUUDS-UHFFFAOYSA-N |
| Melting Point | 75-76C |
| Molecular Weight | 142.18 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |