| SpectraBase Compound ID | AJlQBv5L3BT |
|---|---|
| InChI | InChI=1S/C11H10O3/c1-7-3-4-8-9(13-2)6-11(12)14-10(8)5-7/h3-6H,1-2H3 |
| InChIKey | JZWPAAWHMHCTHZ-UHFFFAOYSA-N |
| Mol Weight | 190.2 g/mol |
| Molecular Formula | C11H10O3 |
| Exact Mass | 190.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BrazaBZhUPp |
|---|---|
| Name | 4-Methyloxy-7-methylcoumarin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.062994179 u |
| Formula | C11H10O3 |
| InChI | InChI=1S/C11H10O3/c1-7-3-4-8-9(13-2)6-11(12)14-10(8)5-7/h3-6H,1-2H3 |
| InChIKey | JZWPAAWHMHCTHZ-UHFFFAOYSA-N |
| Molecular Weight | 190.198 g/mol |
| SMILES | C1(=CC=C2C(=C1)OC(=O)C=C2OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951187 |