| SpectraBase Compound ID | 3H1d4G2dHw1 |
|---|---|
| InChI | InChI=1S/C10H9IO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3/b7-4- |
| InChIKey | IDATZIWFZZIKNZ-DAXSKMNVSA-N |
| Mol Weight | 288.08 g/mol |
| Molecular Formula | C10H9IO2 |
| Exact Mass | 287.964725 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNZDH2mAsja |
|---|---|
| Name | Methyl (Z)-3-(4-iodophenyl)-2-propenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.964724528 u |
| Formula | C10H9IO2 |
| InChI | InChI=1S/C10H9IO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3/b7-4- |
| InChIKey | IDATZIWFZZIKNZ-DAXSKMNVSA-N |
| Molecular Weight | 288.084 g/mol |
| SMILES | C(\C=C/C1=CC=C(C=C1)I)(=O)OC |