| SpectraBase Compound ID | 5E6OAxQh8L8 |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-8(10)11-7-5-6-9(2,3)4/h5-6H,7H2,1-4H3/b6-5+ |
| InChIKey | KGQCWLAKWCETTA-AATRIKPKSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FoH9c28eX13 |
|---|---|
| Name | 2-Penten-1-ol, 4,4-dimethyl-, acetate |
| 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/c1-8(10)11-7-5-6-9(2,3)4/h5-6H,7H2,1-4H3/b6-5+ |
| InChIKey | KGQCWLAKWCETTA-AATRIKPKSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C(=O)(OC\C=C\C(C)(C)C)C |