| SpectraBase Compound ID | GgEZcLfG2aM |
|---|---|
| InChI | InChI=1S/C11H6ClN3/c12-9-3-2-8(7-13)10(6-9)11-14-4-1-5-15-11/h1-6H |
| InChIKey | TUIAMCMPTFZTQN-UHFFFAOYSA-N |
| Mol Weight | 215.64 g/mol |
| Molecular Formula | C11H6ClN3 |
| Exact Mass | 215.025025 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3smCLOBgiW8 |
|---|---|
| Name | 4-Chloro-2-(pyrimidin-2-yl)benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H6ClN3 |
| InChI | InChI=1S/C11H6ClN3/c12-9-3-2-8(7-13)10(6-9)11-14-4-1-5-15-11/h1-6H |
| InChIKey | TUIAMCMPTFZTQN-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo500087g |
| Molecular Weight | 215.643 g/mol |
| SMILES | c1cnc(-c2cc(ccc2C#N)Cl)nc1 |
| SPLASH | splash10-0wmi-9860000000-3824dc57e1741541e724 |
| Source of Spectrum | J-79-3234-2l |
| Wiley ID | 1746136 |