| SpectraBase Compound ID | 4iR9NS1l2JX |
|---|---|
| InChI | InChI=1S/C11H11ClO2/c1-2-14-11(13)8-7-9-5-3-4-6-10(9)12/h3-8H,2H2,1H3/b8-7+ |
| InChIKey | ILTRCHMHGZQVGO-BQYQJAHWSA-N |
| Mol Weight | 210.66 g/mol |
| Molecular Formula | C11H11ClO2 |
| Exact Mass | 210.044757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jv4UAyg63BR |
|---|---|
| Name | 2-Propenoic acid, 3-(2-chlorophenyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.044757292 u |
| Formula | C11H11ClO2 |
| InChI | InChI=1S/C11H11ClO2/c1-2-14-11(13)8-7-9-5-3-4-6-10(9)12/h3-8H,2H2,1H3/b8-7+ |
| InChIKey | ILTRCHMHGZQVGO-BQYQJAHWSA-N |
| Molecular Weight | 210.660 g/mol |
| SMILES | C1=C(C(=CC=C1)Cl)\C=C\C(OCC)=O |