![2-Propenoyl chloride, 3-[4-(acetyloxy)phenyl]-](/api/spectrum/3387NEzUELx/structure.png?h=300&w=458 "2-Propenoyl chloride, 3-[4-(acetyloxy)phenyl]-")
| SpectraBase Compound ID | K5kYyXIsZSM |
|---|---|
| InChI | InChI=1S/C11H9ClO3/c1-8(13)15-10-5-2-9(3-6-10)4-7-11(12)14/h2-7H,1H3/b7-4+ |
| InChIKey | FXTAOSIHTREOSA-QPJJXVBHSA-N |
| Mol Weight | 224.64 g/mol |
| Molecular Formula | C11H9ClO3 |
| Exact Mass | 224.024022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3387NEzUELx |
|---|---|
| Name | 2-Propenoyl chloride, 3-[4-(acetyloxy)phenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.024021847 u |
| Formula | C11H9ClO3 |
| InChI | InChI=1S/C11H9ClO3/c1-8(13)15-10-5-2-9(3-6-10)4-7-11(12)14/h2-7H,1H3/b7-4+ |
| InChIKey | FXTAOSIHTREOSA-QPJJXVBHSA-N |
| Molecular Weight | 224.643 g/mol |
| SMILES | CC(OC1=CC=C(\C=C\C(Cl)=O)C=C1)=O |