| SpectraBase Compound ID | 3wFoBD2Oa5L |
|---|---|
| InChI | InChI=1S/C11H9ClO2/c1-6-3-4-9-8(5-6)11(13)10(12)7(2)14-9/h3-5H,1-2H3 |
| InChIKey | KQYMVKMPAYXDQI-UHFFFAOYSA-N |
| Mol Weight | 208.64 g/mol |
| Molecular Formula | C11H9ClO2 |
| Exact Mass | 208.029107 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HYOS2m2ufS |
|---|---|
| Name | 2,6-Dimethyl-3-chlorochromone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.029107228 u |
| Formula | C11H9ClO2 |
| InChI | InChI=1S/C11H9ClO2/c1-6-3-4-9-8(5-6)11(13)10(12)7(2)14-9/h3-5H,1-2H3 |
| InChIKey | KQYMVKMPAYXDQI-UHFFFAOYSA-N |
| Molecular Weight | 208.644 g/mol |
| SMILES | C=1(C(C=2C=C(C)C=CC2OC1C)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938521 |