| SpectraBase Compound ID | GPm32DRuBeC |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-9(8-10(2)12(13)14)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,13,14)/b10-8- |
| InChIKey | CKTWBJXOYMYIHO-NTMALXAHSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jejc4PPtBqp |
|---|---|
| Name | (Z)-2,4-Dimethyl-4-phenyl-2-butenoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-9(8-10(2)12(13)14)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,13,14)/b10-8- |
| InChIKey | CKTWBJXOYMYIHO-NTMALXAHSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(\C(=C/C(C=1C=CC=CC1)C)C)(=O)O |