| SpectraBase Compound ID | 2NZTpOGPcGr |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-7(10)5-6-8(11)9(2,3)4/h5-6H2,1-4H3 |
| InChIKey | KRCCFFMBFMLRNS-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7wXSzj5WJKe |
|---|---|
| Name | 6,6-Dimethyl-2,5-heptanedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-7(10)5-6-8(11)9(2,3)4/h5-6H2,1-4H3 |
| InChIKey | KRCCFFMBFMLRNS-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C(C(C)(C)C)(=O)CCC(=O)C |