| SpectraBase Compound ID | 87j3mQ5Q7hX |
|---|---|
| InChI | InChI=1S/C9H8N2O2/c1-13-9(12)8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H,10,11) |
| InChIKey | LKUBWDNDGBVKFK-UHFFFAOYSA-N |
| Mol Weight | 176.17 g/mol |
| Molecular Formula | C9H8N2O2 |
| Exact Mass | 176.058578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DiQijGLtJ2e |
|---|---|
| Name | Methyl benzimidazole-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.058577504 u |
| Formula | C9H8N2O2 |
| InChI | InChI=1S/C9H8N2O2/c1-13-9(12)8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H,10,11) |
| InChIKey | LKUBWDNDGBVKFK-UHFFFAOYSA-N |
| Molecular Weight | 176.175 g/mol |
| SMILES | C1=2N=C(NC1=CC=CC2)C(OC)=O |