| SpectraBase Compound ID | HnKWuziDKK5 |
|---|---|
| InChI | InChI=1S/C7H14O/c1-5-6(8)7(2,3)4/h5H2,1-4H3 |
| InChIKey | VLNUTKMHYLQCQB-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CrZiarvjrC7 |
|---|---|
| Name | 2,2-Dimethyl-pentanone-3 |
| CAS Registry Number | 564-04-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-5-6(8)7(2,3)4/h5H2,1-4H3 |
| InChIKey | VLNUTKMHYLQCQB-UHFFFAOYSA-N |
| Instrument Name | Special |
| Literature Reference | G.E. Hawkes, K. Herwig, J.D. Roberts, J. Org. Chem. 39, 1017 (1974). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |