| SpectraBase Compound ID | DC4oZAvPOer |
|---|---|
| InChI | InChI=1S/C14H22O2/c1-9(2)13(15)16-8-10-5-6-11-7-12(10)14(11,3)4/h5,9,11-12H,6-8H2,1-4H3 |
| InChIKey | HPAQTXNDJUZELN-UHFFFAOYSA-N |
| Mol Weight | 222.33 g/mol |
| Molecular Formula | C14H22O2 |
| Exact Mass | 222.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXjfvC256rw |
|---|---|
| Name | Isobutyric acid, 2-pinen-10-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.161979946 u |
| Formula | C14H22O2 |
| InChI | InChI=1S/C14H22O2/c1-9(2)13(15)16-8-10-5-6-11-7-12(10)14(11,3)4/h5,9,11-12H,6-8H2,1-4H3 |
| InChIKey | HPAQTXNDJUZELN-UHFFFAOYSA-N |
| Molecular Weight | 222.328 g/mol |
| SMILES | C(C(C)C)(=O)OCC=1C2C(C(C2)CC1)(C)C |