| SpectraBase Compound ID | 5trcyec48Vl |
|---|---|
| InChI | InChI=1S/C10H8Cl2O/c1-7(13)5-6-8-9(11)3-2-4-10(8)12/h2-6H,1H3/b6-5+ |
| InChIKey | QUUBBGLIJLKARO-AATRIKPKSA-N |
| Mol Weight | 215.08 g/mol |
| Molecular Formula | C10H8Cl2O |
| Exact Mass | 213.99522 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DzOuVHQqrsw |
|---|---|
| Name | 3-Buten-2-one, 4-(2,6-dichlorophenyl)-, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.995220277 u |
| Formula | C10H8Cl2O |
| InChI | InChI=1S/C10H8Cl2O/c1-7(13)5-6-8-9(11)3-2-4-10(8)12/h2-6H,1H3/b6-5+ |
| InChIKey | QUUBBGLIJLKARO-AATRIKPKSA-N |
| Molecular Weight | 215.079 g/mol |
| SMILES | C1(=C(C=CC=C1Cl)Cl)\C=C\C(C)=O |