| SpectraBase Compound ID | 4Y9DQnQcReH |
|---|---|
| InChI | InChI=1S/C12H12N2O2/c1-14-8-7-13-11(14)12(15)16-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3 |
| InChIKey | IAAICIMHWRAJCH-UHFFFAOYSA-N |
| Mol Weight | 216.24 g/mol |
| Molecular Formula | C12H12N2O2 |
| Exact Mass | 216.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AkjSEMZC075 |
|---|---|
| Name | Benzyl 1-methylimidazole-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.089877632 u |
| Formula | C12H12N2O2 |
| InChI | InChI=1S/C12H12N2O2/c1-14-8-7-13-11(14)12(15)16-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3 |
| InChIKey | IAAICIMHWRAJCH-UHFFFAOYSA-N |
| Molecular Weight | 216.240 g/mol |
| SMILES | C1(=NC=CN1C)C(=O)OCC=1C=CC=CC1 |