| SpectraBase Compound ID | 9F3kfxN7unG |
|---|---|
| InChI | InChI=1S/C12H8ClN/c13-11-5-4-9-2-1-3-12(9)10(8-11)6-7-14/h1-5,8H,6H2 |
| InChIKey | WXSBRQORLNVTTE-UHFFFAOYSA-N |
| Mol Weight | 201.66 g/mol |
| Molecular Formula | C12H8ClN |
| Exact Mass | 201.034527 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E6DvNjlfylU |
|---|---|
| Name | 6-Chloro-4-(cyanomethyl)azulene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8ClN |
| InChI | InChI=1S/C12H8ClN/c13-11-5-4-9-2-1-3-12(9)10(8-11)6-7-14/h1-5,8H,6H2 |
| InChIKey | WXSBRQORLNVTTE-UHFFFAOYSA-N |
| Molecular Weight | 201.656 g/mol |
| SMILES | c1ccc2c(cc(ccc12)Cl)CC#N |
| SPLASH | splash10-0uxr-0980000000-4b4cb7cd882feb0c0722 |
| Source of Spectrum | U-1994-617-7 |
| Synonyms | (6-chloro-4-azulenyl)acetonitrile |
| Wiley ID | 765968 |