| SpectraBase Compound ID | 4o1BPWtJHnc |
|---|---|
| InChI | InChI=1S/C12H17N3O4S/c1-4-18-10(16)8-6-7-9(15(8)3)13-11(20)14-12(17)19-5-2/h6-7H,4-5H2,1-3H3,(H2,13,14,17,20) |
| InChIKey | MNQTZUIGFOHFSU-UHFFFAOYSA-N |
| Mol Weight | 299.35 g/mol |
| Molecular Formula | C12H17N3O4S |
| Exact Mass | 299.093977 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 89L0QiNQM8U |
|---|---|
| Name | 5-(3-carboxy-2-thioureido)-1-methylpyrrole-2-carboxylic acid, diethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H17N3O4S |
| InChI | InChI=1S/C12H17N3O4S/c1-4-18-10(16)8-6-7-9(15(8)3)13-11(20)14-12(17)19-5-2/h6-7H,4-5H2,1-3H3,(H2,13,14,17,20) |
| InChIKey | MNQTZUIGFOHFSU-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 32228M |
| Solvent | CDCl3 |