![[(4-acetyl-o-phenylene)dithio]diacetic acid](/api/spectrum/9zYWVWucqgz/structure.png?h=300&w=458 "[(4-acetyl-o-phenylene)dithio]diacetic acid")
| SpectraBase Compound ID | 3x7Lc3ET9WC |
|---|---|
| InChI | InChI=1S/C12H12O5S2/c1-7(13)8-2-3-9(18-5-11(14)15)10(4-8)19-6-12(16)17/h2-4H,5-6H2,1H3,(H,14,15)(H,16,17) |
| InChIKey | SHZSIYZRSLJWMO-UHFFFAOYSA-N |
| Mol Weight | 300.34 g/mol |
| Molecular Formula | C12H12O5S2 |
| Exact Mass | 300.012616 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9zYWVWucqgz |
|---|---|
| Name | [(4-acetyl-o-phenylene)dithio]diacetic acid |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O5S2 |
| InChI | InChI=1S/C12H12O5S2/c1-7(13)8-2-3-9(18-5-11(14)15)10(4-8)19-6-12(16)17/h2-4H,5-6H2,1H3,(H,14,15)(H,16,17) |
| InChIKey | SHZSIYZRSLJWMO-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 18072M |
| Solvent | Polysol |