| SpectraBase Compound ID | 6JWsHp8SrsU |
|---|---|
| InChI | InChI=1S/C12H11ClN2/c13-7-4-2-1-3-5-12-9-11(10-14)6-8-15-12/h6,8-9H,1-2,4,7H2 |
| InChIKey | OUSKOGXUWCKNQE-UHFFFAOYSA-N |
| Mol Weight | 218.69 g/mol |
| Molecular Formula | C12H11ClN2 |
| Exact Mass | 218.061076 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6OD7nLTN97L |
|---|---|
| Name | 2-(6-Chlorohex-1-yn-1-yl)isonicotinonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H11ClN2 |
| InChI | InChI=1S/C12H11ClN2/c13-7-4-2-1-3-5-12-9-11(10-14)6-8-15-12/h6,8-9H,1-2,4,7H2 |
| InChIKey | OUSKOGXUWCKNQE-UHFFFAOYSA-N |
| Molecular Weight | 218.687 g/mol |
| SMILES | c1c(C#N)cc(nc1)C#CCCCCCl |
| SPLASH | splash10-0a59-0900000000-7b4d5bf7e7c0ddafcf3b |
| Source of Spectrum | ACI-53-SMS3-7b |
| Wiley ID | 1782375 |