| SpectraBase Compound ID | LE7whPmsn6W |
|---|---|
| InChI | InChI=1S/C16H14ClN3OS/c1-22-16(20-11-18)19-10-13-14(17)8-5-9-15(13)21-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,19,20) |
| InChIKey | OUQKIOIWXROUAI-UHFFFAOYSA-N |
| Mol Weight | 331.82 g/mol |
| Molecular Formula | C16H14ClN3OS |
| Exact Mass | 331.054611 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H18uaL8uyUZ |
|---|---|
| Name | 3-(2-chloro-6-phenoxybenzyl)-1-cyano-2-methyl-2-thiopseudourea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H14ClN3OS |
| InChI | InChI=1S/C16H14ClN3OS/c1-22-16(20-11-18)19-10-13-14(17)8-5-9-15(13)21-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,19,20) |
| InChIKey | OUQKIOIWXROUAI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58352M |
| Solvent | Polysol |