| SpectraBase Compound ID | Cj1qFTGparo |
|---|---|
| InChI | InChI=1S/C14H15N3O3/c1-3-20-14(19)12-11(15-8-16-12)13(18)17-10-7-5-4-6-9(10)2/h4-8H,3H2,1-2H3,(H,15,16)(H,17,18) |
| InChIKey | DNJILOSWVKTMGB-UHFFFAOYSA-N |
| Mol Weight | 273.29 g/mol |
| Molecular Formula | C14H15N3O3 |
| Exact Mass | 273.111341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6eKFVJVIwvu |
|---|---|
| Name | 5-o-Tolylcarbamoyl-3H-imidazole-4-carboxylic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.111341352 u |
| Formula | C14H15N3O3 |
| InChI | InChI=1S/C14H15N3O3/c1-3-20-14(19)12-11(15-8-16-12)13(18)17-10-7-5-4-6-9(10)2/h4-8H,3H2,1-2H3,(H,15,16)(H,17,18) |
| InChIKey | DNJILOSWVKTMGB-UHFFFAOYSA-N |
| SMILES | C1(=C(C(=O)OCC)NC=N1)C(NC1=C(C)C=CC=C1)=O |