| SpectraBase Compound ID | AC1Pwfnb53y |
|---|---|
| InChI | InChI=1S/C15H11ClO3/c16-11-5-7-15(19)13(9-11)14(18)6-4-10-2-1-3-12(17)8-10/h1-9,17,19H/b6-4+ |
| InChIKey | BJLBUIYKSNQHQA-GQCTYLIASA-N |
| Mol Weight | 274.7 g/mol |
| Molecular Formula | C15H11ClO3 |
| Exact Mass | 274.039672 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Di0hlSKmQHd |
|---|---|
| Name | 5'-Chloro-2',3-dihydroxy-chalcone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.039671911 u |
| Formula | C15H11ClO3 |
| InChI | InChI=1S/C15H11ClO3/c16-11-5-7-15(19)13(9-11)14(18)6-4-10-2-1-3-12(17)8-10/h1-9,17,19H/b6-4+ |
| InChIKey | BJLBUIYKSNQHQA-GQCTYLIASA-N |
| SMILES | C=1(O)C=C(\C=C\C(=O)C2=C(O)C=CC(Cl)=C2)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97026 |