| SpectraBase Compound ID | 6PRkUFq6H8Y |
|---|---|
| InChI | InChI=1S/C6H9NO/c1-5(2)3-6(8)4-7/h5H,3H2,1-2H3 |
| InChIKey | UYCTVHPXUZNWSQ-UHFFFAOYSA-N |
| Mol Weight | 111.14 g/mol |
| Molecular Formula | C6H9NO |
| Exact Mass | 111.068414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FeS0qZiJYqm |
|---|---|
| Name | 2-keto-4-methyl-valeronitrile |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H9NO |
| InChI | InChI=1S/C6H9NO/c1-5(2)3-6(8)4-7/h5H,3H2,1-2H3 |
| InChIKey | UYCTVHPXUZNWSQ-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 111.144 g/mol |
| Source File Reference | MHKO5908 |