| SpectraBase Compound ID | IwvhYMRR7kW |
|---|---|
| InChI | InChI=1S/C13H24O2/c1-10(2)8-11(3)6-7-12(4)9-15-13(5)14/h8,11-12H,6-7,9H2,1-5H3 |
| InChIKey | IGTIDBKNQZNSPZ-UHFFFAOYSA-N |
| Mol Weight | 212.33 g/mol |
| Molecular Formula | C13H24O2 |
| Exact Mass | 212.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3FQgQFCaQHc |
|---|---|
| Name | 2,5,7-Trimethyl-6-octen-1-yl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.177630011 u |
| Formula | C13H24O2 |
| InChI | InChI=1S/C13H24O2/c1-10(2)8-11(3)6-7-12(4)9-15-13(5)14/h8,11-12H,6-7,9H2,1-5H3 |
| InChIKey | IGTIDBKNQZNSPZ-UHFFFAOYSA-N |
| Molecular Weight | 212.333 g/mol |
| SMILES | C(C)(=O)OCC(CCC(C=C(C)C)C)C |