| SpectraBase Compound ID | 2089Ckpl82N |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-11(10-16-14(2,3)4)17-13(15)12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3 |
| InChIKey | SYINEEOOMQWXKT-UHFFFAOYSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C14H20O3 |
| Exact Mass | 236.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkkGP2Kg7Tg |
|---|---|
| Name | 1-Tert-butoxypropan-2-yl benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.141244501 u |
| Formula | C14H20O3 |
| InChI | InChI=1S/C14H20O3/c1-11(10-16-14(2,3)4)17-13(15)12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3 |
| InChIKey | SYINEEOOMQWXKT-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | CC(C)(C)OCC(OC(=O)C1=CC=CC=C1)C |