Octyl acetate. Properties Structure Search. octyl acetate 112-14-1 NMR spectrum, octyl acetate H-NMR spectral analysis, octyl acetate C-NMR spectral analysis ect. Specifically, a chemical with this code is not associated with a low level of hazard concern for all human health and environmental endpoints. 1H Nuclear Magnetic Resonance (NMR) Chemical Shifts of n-Octyl acetate with properties. : 112-14-1; Formula: C10H20O2 ... -1-octyl acetate; 1H NMR prediction; Post Buying Request . octyl acetate CAS No. Properties Structure Search. NMR Predictor: Predict (works with chrome or firefox) Category: flavor and ... in citrus peel oils, wheat bread, cheddar cheese, wines, banana, sour cherry and other foodstuffs. Compound n-Octyl acetate with free spectra: 2 NMR, 8 FTIR, and 1 Raman. Flavour ingredient Octyl acetate, or octyl ethanoate, is an ester that is formed from octanol (octyl alcohol) and acetic acid. Chemical: Octyl acetate Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues.