| SpectraBase Compound ID | HXzFqb8tlud |
|---|---|
| InChI | InChI=1S/C13H18N4O2S2/c1-2-19-13(18)15-12(21)17-16-11(20)14-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,14,16,20)(H2,15,17,18,21) |
| InChIKey | HDCSXCDQBARHBC-UHFFFAOYSA-N |
| Mol Weight | 326.43 g/mol |
| Molecular Formula | C13H18N4O2S2 |
| Exact Mass | 326.087118 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BJW4LtLNTga |
|---|---|
| Name | 4-(3-phenethyl-2-thioureido)-3-thioallophanic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H18N4O2S2 |
| InChI | InChI=1S/C13H18N4O2S2/c1-2-19-13(18)15-12(21)17-16-11(20)14-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,14,16,20)(H2,15,17,18,21) |
| InChIKey | HDCSXCDQBARHBC-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 24864M |
| Solvent | DMSO-d6 |