| SpectraBase Compound ID | C5q5RoE2mhp |
|---|---|
| InChI | InChI=1S/C12H11N3O/c1-9-4-2-3-5-10(9)15-12(16)11-8-13-6-7-14-11/h2-8H,1H3,(H,15,16) |
| InChIKey | CXFOPMCVXUCBBC-UHFFFAOYSA-N |
| Mol Weight | 213.24 g/mol |
| Molecular Formula | C12H11N3O |
| Exact Mass | 213.090212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Adh9UMgNxC |
|---|---|
| Name | N-(2-Methylphenyl)-2-pyrazinecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.090211985 u |
| Formula | C12H11N3O |
| InChI | InChI=1S/C12H11N3O/c1-9-4-2-3-5-10(9)15-12(16)11-8-13-6-7-14-11/h2-8H,1H3,(H,15,16) |
| InChIKey | CXFOPMCVXUCBBC-UHFFFAOYSA-N |
| Molecular Weight | 213.240 g/mol |
| SMILES | C1(NC(=O)C2=NC=CN=C2)=C(C=CC=C1)C |