![3-Oxabicyclo[3.2.0]hept-6-ene-2,4-dione, 1-methyl-](/api/spectrum/4ptgPpYbc3p/structure.png?h=300&w=458 "3-Oxabicyclo[3.2.0]hept-6-ene-2,4-dione, 1-methyl-")
| SpectraBase Compound ID | KUUnE3y2GhK |
|---|---|
| InChI | InChI=1S/C7H6O3/c1-7-3-2-4(7)5(8)10-6(7)9/h2-4H,1H3 |
| InChIKey | LPZCHIFBCLWFJM-UHFFFAOYSA-N |
| Mol Weight | 138.12 g/mol |
| Molecular Formula | C7H6O3 |
| Exact Mass | 138.031694 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4ptgPpYbc3p |
|---|---|
| Name | 3-Oxabicyclo[3.2.0]hept-6-ene-2,4-dione, 1-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.031694050 u |
| Formula | C7H6O3 |
| InChI | InChI=1S/C7H6O3/c1-7-3-2-4(7)5(8)10-6(7)9/h2-4H,1H3 |
| InChIKey | LPZCHIFBCLWFJM-UHFFFAOYSA-N |
| Molecular Weight | 138.122 g/mol |
| SMILES | C1(=O)OC(C2C1(C)C=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.989678 |