![2-[p-(2-chloro-6-fluorostyryl)benzyl]-3-(m-chlorophenyl)-2-thiopseudourea, monohydrobromide](/api/spectrum/Eb6ChIDgaj1/structure.png?h=300&w=458 "2-[p-(2-chloro-6-fluorostyryl)benzyl]-3-(m-chlorophenyl)-2-thiopseudourea, monohydrobromide")
| SpectraBase Compound ID | KsrUK9rAtEU |
|---|---|
| InChI | InChI=1S/C22H17Cl2FN2S.BrH/c23-17-3-1-4-18(13-17)27-22(26)28-14-16-9-7-15(8-10-16)11-12-19-20(24)5-2-6-21(19)25;/h1-13H,14H2,(H2,26,27);1H |
| InChIKey | PGIULKZHPAKEKR-UHFFFAOYSA-N |
| Mol Weight | 512.268 g/mol |
| Molecular Formula | C22H18BrCl2FN2S |
| Exact Mass | 509.973516 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eb6ChIDgaj1 |
|---|---|
| Name | 2-[p-(2-chloro-6-fluorostyryl)benzyl]-3-(m-chlorophenyl)-2-thiopseudourea, monohydrobromide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H18BrCl2FN2S |
| InChI | InChI=1S/C22H17Cl2FN2S.BrH/c23-17-3-1-4-18(13-17)27-22(26)28-14-16-9-7-15(8-10-16)11-12-19-20(24)5-2-6-21(19)25;/h1-13H,14H2,(H2,26,27);1H |
| InChIKey | PGIULKZHPAKEKR-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48036M |
| Solvent | DMSO-d6 |