![[(4,6-dichloro-m-tolyl)thio]acetic acid](/api/spectrum/9nJRgv55I3d/structure.png?h=300&w=458 "[(4,6-dichloro-m-tolyl)thio]acetic acid")
| SpectraBase Compound ID | 5EAH2nGB3aS |
|---|---|
| InChI | InChI=1S/C9H8Cl2O2S/c1-5-2-8(14-4-9(12)13)7(11)3-6(5)10/h2-3H,4H2,1H3,(H,12,13) |
| InChIKey | VPCNIUHVMZIJDP-UHFFFAOYSA-N |
| Mol Weight | 251.13 g/mol |
| Molecular Formula | C9H8Cl2O2S |
| Exact Mass | 249.962206 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 9nJRgv55I3d |
|---|---|
| Name | [(4,6-DICHLORO-m-TOLYL)THIO]ACETIC ACID |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8Cl2O2S |
| InChI | InChI=1S/C9H8Cl2O2S/c1-5-2-8(14-4-9(12)13)7(11)3-6(5)10/h2-3H,4H2,1H3,(H,12,13) |
| InChIKey | VPCNIUHVMZIJDP-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Molecular Weight | 251.13 |
| Solvent | DMSO-d6; Reference=TMS; Temperature 297K |