| SpectraBase Compound ID | 2Ey7s0KYCkM |
|---|---|
| InChI | InChI=1S/C7H6O4S/c8-6(9)5(7(10)11)4-1-2-12-3-4/h1-3,5H,(H,8,9)(H,10,11) |
| InChIKey | GCOOGCQWQFRJEK-UHFFFAOYSA-N |
| Mol Weight | 186.18 g/mol |
| Molecular Formula | C7H6O4S |
| Exact Mass | 185.99868 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | CM2Sz1gcEkR |
|---|---|
| Name | 3-THIOPHENEMALONIC ACID |
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| CAS Registry Number | 21080-92-2 |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6O4S |
| InChI | InChI=1S/C7H6O4S/c8-6(9)5(7(10)11)4-1-2-12-3-4/h1-3,5H,(H,8,9)(H,10,11) |
| InChIKey | GCOOGCQWQFRJEK-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Molecular Weight | 186.19 |
| Solvent | DMSO-d6; Reference=TMS; Temperature 297K |