| SpectraBase Compound ID | 6GJOD3xLwXN |
|---|---|
| InChI | InChI=1S/C12H9N/c13-9-8-10-4-6-11-2-1-3-12(11)7-5-10/h1-7H,8H2 |
| InChIKey | BRJMKCPRFHDNTK-UHFFFAOYSA-N |
| Mol Weight | 167.21 g/mol |
| Molecular Formula | C12H9N |
| Exact Mass | 167.073499 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8njlfo0ha8M |
|---|---|
| Name | 6-(Cyanomethyl}azulene |
| Alternate Name(s) | 6-Azulenylacetonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H9N |
| InChI | InChI=1S/C12H9N/c13-9-8-10-4-6-11-2-1-3-12(11)7-5-10/h1-7H,8H2 |
| InChIKey | BRJMKCPRFHDNTK-UHFFFAOYSA-N |
| Molecular Weight | 167.211 g/mol |
| SMILES | c12c(ccc(cc2)CC#N)ccc1 |
| SPLASH | splash10-014i-0900000000-debede06ff27e0484534 |
| Source of Spectrum | U-1994-617-4 |
| Wiley ID | 765973 |