| SpectraBase Compound ID | B4ZzLyXf8Od |
|---|---|
| InChI | InChI=1S/C11H11NO/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3 |
| InChIKey | DAWKKCQLIURYLL-UHFFFAOYSA-N |
| Mol Weight | 173.21 g/mol |
| Molecular Formula | C11H11NO |
| Exact Mass | 173.084064 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IdCqjHWayYU |
|---|---|
| Name | A-benzoyl butyronitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11NO |
| InChI | InChI=1S/C11H11NO/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3 |
| InChIKey | DAWKKCQLIURYLL-UHFFFAOYSA-N |
| Molecular Weight | 173.215 g/mol |
| SMILES | C(C(CC)C(c1ccccc1)=O)#N |
| SPLASH | splash10-0a4i-4900000000-d358c3228585083a9c96 |
| Source of Spectrum | JX-2015-6-6927 |
| Synonyms | 2-Benzoylbutanenitrile 2-(Phenylcarbonyl)butanenitrile |
| Wiley ID | 1729520 |