| SpectraBase Compound ID | 48qAiJ4ppxT |
|---|---|
| InChI | InChI=1S/C11H6FN3/c12-9-2-3-10(8(6-9)7-13)11-14-4-1-5-15-11/h1-6H |
| InChIKey | MGMLHWNLCXIFKY-UHFFFAOYSA-N |
| Mol Weight | 199.19 g/mol |
| Molecular Formula | C11H6FN3 |
| Exact Mass | 199.054575 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CtToJazKhG3 |
|---|---|
| Name | 5-Fluoro-2-(pyrimidin-2-yl)benzonitrile |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H6FN3 |
| InChI | InChI=1S/C11H6FN3/c12-9-2-3-10(8(6-9)7-13)11-14-4-1-5-15-11/h1-6H |
| InChIKey | MGMLHWNLCXIFKY-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo500087g |
| Molecular Weight | 199.188 g/mol |
| SMILES | c1cnc(-c2ccc(cc2C#N)F)nc1 |
| SPLASH | splash10-0f6t-6900000000-32a203cc5607d52bcf1e |
| Source of Spectrum | J-79-3233-2f |
| Wiley ID | 1746131 |