| SpectraBase Compound ID | F2bVRTfHU0l |
|---|---|
| InChI | InChI=1S/C12H11N3O2/c1-17-10-4-2-3-9(7-10)15-12(16)11-8-13-5-6-14-11/h2-8H,1H3,(H,15,16) |
| InChIKey | OWKHKJVMWVCRKQ-UHFFFAOYSA-N |
| Mol Weight | 229.24 g/mol |
| Molecular Formula | C12H11N3O2 |
| Exact Mass | 229.085127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IXUnQRwazr9 |
|---|---|
| Name | N-(3-Methoxyphenyl)-2-pyrazinecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.085126604 u |
| Formula | C12H11N3O2 |
| InChI | InChI=1S/C12H11N3O2/c1-17-10-4-2-3-9(7-10)15-12(16)11-8-13-5-6-14-11/h2-8H,1H3,(H,15,16) |
| InChIKey | OWKHKJVMWVCRKQ-UHFFFAOYSA-N |
| Molecular Weight | 229.239 g/mol |
| SMILES | N(C(C=1N=CC=NC1)=O)C=1C=C(OC)C=CC1 |