![3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile, O-acetyloxime](/api/spectrum/py1da1ZW3b/structure.png?h=300&w=458 "3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile, O-acetyloxime")
| SpectraBase Compound ID | C3jOqU91oe0 |
|---|---|
| InChI | InChI=1S/C12H12N2O2S2/c1-7(15)16-14-9-5-3-4-8-10(6-13)18-12(17-2)11(8)9/h3-5H2,1-2H3 |
| InChIKey | KGQLGVAHAYYCAW-UHFFFAOYSA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C12H12N2O2S2 |
| Exact Mass | 280.03402 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | py1da1ZW3b |
|---|---|
| Name | 3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile, O-acetyloxime |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12N2O2S2 |
| InChI | InChI=1S/C12H12N2O2S2/c1-7(15)16-14-9-5-3-4-8-10(6-13)18-12(17-2)11(8)9/h3-5H2,1-2H3 |
| InChIKey | KGQLGVAHAYYCAW-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61258M |
| Solvent | CDCl3 |