| SpectraBase Compound ID | BWcDRwDK9uZ |
|---|---|
| InChI | InChI=1S/C7H11NO/c1-6(9)4-7(2,3)5-8/h4H2,1-3H3 |
| InChIKey | XHJHGJBVGBKYJD-UHFFFAOYSA-N |
| Mol Weight | 125.17 g/mol |
| Molecular Formula | C7H11NO |
| Exact Mass | 125.084064 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1JPAlV1VPZg |
|---|---|
| Name | 2,2-Dimethyl-4-oxopentanenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO |
| InChI | InChI=1S/C7H11NO/c1-6(9)4-7(2,3)5-8/h4H2,1-3H3 |
| InChIKey | XHJHGJBVGBKYJD-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/adsc.201600287 |
| Molecular Weight | 125.171 g/mol |
| SMILES | C(CC(=O)C)(C)(C)C#N |
| SPLASH | splash10-0a4i-9000000000-10bdcc04024419d10433 |
| Source of Spectrum | ASC-358-2134/SM7-3d |
| Wiley ID | 1807437 |