| SpectraBase Compound ID | 7f2yS4ZYWLr |
|---|---|
| InChI | InChI=1S/C12H7NO2/c13-7-9-3-1-2-4-11(9)12-6-5-10(8-14)15-12/h1-6,8H |
| InChIKey | AXHWLBNYUIICMH-UHFFFAOYSA-N |
| Mol Weight | 197.19 g/mol |
| Molecular Formula | C12H7NO2 |
| Exact Mass | 197.047678 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2uDJVUKrmkq |
|---|---|
| Name | 2-(5-Formyl-2-furyl)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.047678467 u |
| Formula | C12H7NO2 |
| InChI | InChI=1S/C12H7NO2/c13-7-9-3-1-2-4-11(9)12-6-5-10(8-14)15-12/h1-6,8H |
| InChIKey | AXHWLBNYUIICMH-UHFFFAOYSA-N |
| Molecular Weight | 197.193 g/mol |
| SMILES | C(C1=C(C=CC=C1)C=1OC(C=O)=CC1)#N |