| SpectraBase Compound ID | 2flUdAjI32r |
|---|---|
| InChI | InChI=1S/C12H11N3O/c13-10-5-3-9(4-6-10)12(16)15-11-2-1-7-14-8-11/h1-8H,13H2,(H,15,16) |
| InChIKey | WCXIIJKFSVCDPK-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 | IxSqiUJB3Gx |
|---|---|
| Name | 4-Amino-N-(3-pyridinyl)benzamide |
| 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/c13-10-5-3-9(4-6-10)12(16)15-11-2-1-7-14-8-11/h1-8H,13H2,(H,15,16) |
| InChIKey | WCXIIJKFSVCDPK-UHFFFAOYSA-N |
| Molecular Weight | 213.240 g/mol |
| SMILES | C1(NC(=O)C2=CC=C(C=C2)N)=CN=CC=C1 |