| SpectraBase Compound ID | DToXo4yHBOO |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-2-6-11(15-9-12(13)14)10-7-4-3-5-8-10/h2-5,7-8,11H,1,6,9H2,(H,13,14) |
| InChIKey | IFCXZIXTGGUYNQ-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 | McuzdjGshc |
|---|---|
| Name | 2-(1-Phenylbut-3-enoxy)acetic acid |
| 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/c1-2-6-11(15-9-12(13)14)10-7-4-3-5-8-10/h2-5,7-8,11H,1,6,9H2,(H,13,14) |
| InChIKey | IFCXZIXTGGUYNQ-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C(=O)(COC(C=1C=CC=CC1)CC=C)O |