| SpectraBase Compound ID | ESRQiQExGMx |
|---|---|
| InChI | InChI=1S/C24H31N3O3S/c1-2-3-4-8-17-30-22(28)18-26-23(29)20-11-13-21(14-12-20)27-24(31)25-16-15-19-9-6-5-7-10-19/h5-7,9-14H,2-4,8,15-18H2,1H3,(H,26,29)(H2,25,27,31) |
| InChIKey | QKQMJAXHOHXWFY-UHFFFAOYSA-N |
| Mol Weight | 441.59 g/mol |
| Molecular Formula | C24H31N3O3S |
| Exact Mass | 441.208613 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkRRq8kCg1l |
|---|---|
| Name | p-(3-phenethyl-2-thioureido)hippuric acid, hexyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H31N3O3S |
| InChI | InChI=1S/C24H31N3O3S/c1-2-3-4-8-17-30-22(28)18-26-23(29)20-11-13-21(14-12-20)27-24(31)25-16-15-19-9-6-5-7-10-19/h5-7,9-14H,2-4,8,15-18H2,1H3,(H,26,29)(H2,25,27,31) |
| InChIKey | QKQMJAXHOHXWFY-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 28188M |
| Solvent | CDCl3 |