| SpectraBase Compound ID | Ar3pyOKkGHG |
|---|---|
| InChI | InChI=1S/C12H12O3/c13-11(10-4-2-1-3-5-10)12(14)15-8-9-6-7-9/h1-5,9H,6-8H2 |
| InChIKey | IMWYVUMCCBXQOO-UHFFFAOYSA-N |
| Mol Weight | 204.22 g/mol |
| Molecular Formula | C12H12O3 |
| Exact Mass | 204.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DYxbfYVufHE |
|---|---|
| Name | 2-Keto-2-phenyl-acetic acid cyclopropylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.078644243 u |
| Formula | C12H12O3 |
| InChI | InChI=1S/C12H12O3/c13-11(10-4-2-1-3-5-10)12(14)15-8-9-6-7-9/h1-5,9H,6-8H2 |
| InChIKey | IMWYVUMCCBXQOO-UHFFFAOYSA-N |
| Molecular Weight | 204.225 g/mol |
| SMILES | C(C(=O)C1=CC=CC=C1)(OCC1CC1)=O |