| SpectraBase Compound ID | JEAMSDHC40A |
|---|---|
| InChI | InChI=1S/C8H14O2/c1-4-5-6-7(9)8(2,3)10/h4,10H,1,5-6H2,2-3H3 |
| InChIKey | VYTREIXGHYAEES-UHFFFAOYSA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CPviQv6AB5g |
|---|---|
| Name | 2-Hydroxy-2-methylhept-6-en-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c1-4-5-6-7(9)8(2,3)10/h4,10H,1,5-6H2,2-3H3 |
| InChIKey | VYTREIXGHYAEES-UHFFFAOYSA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C(=O)(CCC=C)C(C)(C)O |