| SpectraBase Compound ID | EzvsTwNAoAP |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-12(2,8-15-9-13)11(14)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChIKey | DYTALMUQOSYUNY-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BtIEfKVkLeJ |
|---|---|
| Name | 2,2-Dimethyl-3-oxo-3-phenypropyl formate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.094294308 u |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-12(2,8-15-9-13)11(14)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChIKey | DYTALMUQOSYUNY-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C(C(COC=O)(C)C)(=O)C1=CC=CC=C1 |