| SpectraBase Compound ID | APOSPLbdH7n |
|---|---|
| InChI | InChI=1S/C9H11ClN4OS/c1-5-4-6(10)2-3-7(5)12-9(15)14-13-8(11)16/h2-4H,1H3,(H3,11,13,16)(H2,12,14,15) |
| InChIKey | JSCNYWFOFICHSS-UHFFFAOYSA-N |
| Mol Weight | 258.73 g/mol |
| Molecular Formula | C9H11ClN4OS |
| Exact Mass | 258.03421 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2oNExr1fhWJ |
|---|---|
| Name | 1-(4-chloro-o-tolyl)-5-thiobiurea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H11ClN4OS |
| InChI | InChI=1S/C9H11ClN4OS/c1-5-4-6(10)2-3-7(5)12-9(15)14-13-8(11)16/h2-4H,1H3,(H3,11,13,16)(H2,12,14,15) |
| InChIKey | JSCNYWFOFICHSS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59474M |
| Solvent | DMSO-d6 |