| SpectraBase Compound ID | F3tZdfApWuQ |
|---|---|
| InChI | InChI=1S/C9H8ClN/c1-7-2-8(5-10)4-9(3-7)6-11/h2-4H,5H2,1H3 |
| InChIKey | XVHWQNWFHKUYBX-UHFFFAOYSA-N |
| Mol Weight | 165.62 g/mol |
| Molecular Formula | C9H8ClN |
| Exact Mass | 165.034527 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A8mgUjFCDy2 |
|---|---|
| Name | 3-(chloromethyl)-5-methylbenzonitrile |
| Alternate Name(s) | 3-(chloromethyl)-5-methyl-benzenecarbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8ClN |
| InChI | InChI=1S/C9H8ClN/c1-7-2-8(5-10)4-9(3-7)6-11/h2-4H,5H2,1H3 |
| InChIKey | XVHWQNWFHKUYBX-UHFFFAOYSA-N |
| Molecular Weight | 165.623 g/mol |
| SMILES | C(#N)c1cc(C)cc(c1)CCl |
| SPLASH | splash10-001i-2900000000-331b5c12fc8b053053f4 |
| Source of Spectrum | O1-32-1455-2 |
| Wiley ID | 819106 |