| SpectraBase Compound ID | 4oqesIZwLSR |
|---|---|
| InChI | InChI=1S/C21H21N3O5S/c1-16-3-7-18(8-4-16)9-12-20-21(24(25)26)23(15-22-20)13-14-29-30(27,28)19-10-5-17(2)6-11-19/h3-12,15H,13-14H2,1-2H3 |
| InChIKey | OEEXPMDRDDXZOQ-UHFFFAOYSA-N |
| Mol Weight | 427.48 g/mol |
| Molecular Formula | C21H21N3O5S |
| Exact Mass | 427.120192 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2yK0RX5qkiS |
|---|---|
| Name | 4-(p-methylstyryl)-5-nitroimidazole-1-ethanol, p-toluenesulfonate (ester) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H21N3O5S |
| InChI | InChI=1S/C21H21N3O5S/c1-16-3-7-18(8-4-16)9-12-20-21(24(25)26)23(15-22-20)13-14-29-30(27,28)19-10-5-17(2)6-11-19/h3-12,15H,13-14H2,1-2H3 |
| InChIKey | OEEXPMDRDDXZOQ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 51990M |
| Solvent | CDCl3 |