![4-Methyl-3H-furo[3,2-c]pyran-2,6-dione](/api/spectrum/427A8YBTYlg/structure.png?h=300&w=458 "4-Methyl-3H-furo[3,2-c]pyran-2,6-dione")
| SpectraBase Compound ID | HaWI4iPlova |
|---|---|
| InChI | InChI=1S/C8H6O4/c1-4-5-2-7(9)12-6(5)3-8(10)11-4/h3H,2H2,1H3 |
| InChIKey | RQDQARBZOAKRSS-UHFFFAOYSA-N |
| Mol Weight | 166.13 g/mol |
| Molecular Formula | C8H6O4 |
| Exact Mass | 166.026609 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 427A8YBTYlg |
|---|---|
| Name | 4-Methyl-3H-furo[3,2-C]pyran-2,6-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.026608669 u |
| Formula | C8H6O4 |
| InChI | InChI=1S/C8H6O4/c1-4-5-2-7(9)12-6(5)3-8(10)11-4/h3H,2H2,1H3 |
| InChIKey | RQDQARBZOAKRSS-UHFFFAOYSA-N |
| Molecular Weight | 166.132 g/mol |
| SMILES | C1=2C(=C(C)OC(C2)=O)CC(O1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986285 |