| SpectraBase Compound ID | F7vzYEJqX6g |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h8H,2,5-6H2,1,3-4H3 |
| InChIKey | FSSVRXASHHVANB-UHFFFAOYSA-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 | 2IOq9ksLYY1 |
|---|---|
| Name | Butanoic acid, 2-methyl-, 2-methyl-2-propenyl ester |
| 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/c1-5-8(4)9(10)11-6-7(2)3/h8H,2,5-6H2,1,3-4H3 |
| InChIKey | FSSVRXASHHVANB-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C(C(CC)C)(=O)OCC(=C)C |