![2,3-Diketo-6-methoxybenzo[B]pyran](/api/spectrum/FiwsLPvECye/structure.png?h=300&w=458 "2,3-Diketo-6-methoxybenzo[B]pyran")
| SpectraBase Compound ID | 13qLDK99MzS |
|---|---|
| InChI | InChI=1S/C10H8O4/c1-13-7-2-3-9-6(4-7)5-8(11)10(12)14-9/h2-4H,5H2,1H3 |
| InChIKey | ICVFSCKNEXUJKQ-UHFFFAOYSA-N |
| Mol Weight | 192.17 g/mol |
| Molecular Formula | C10H8O4 |
| Exact Mass | 192.042259 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FiwsLPvECye |
|---|---|
| Name | 2,3-Diketo-6-methoxybenzo[B]pyran |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.042258734 u |
| Formula | C10H8O4 |
| InChI | InChI=1S/C10H8O4/c1-13-7-2-3-9-6(4-7)5-8(11)10(12)14-9/h2-4H,5H2,1H3 |
| InChIKey | ICVFSCKNEXUJKQ-UHFFFAOYSA-N |
| Molecular Weight | 192.170 g/mol |
| SMILES | C1(C(OC=2C(C1)=CC(=CC2)OC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972939 |