![Bicyclo[5.3.0]dec-1(7)-ene-2,5-dione](/api/spectrum/K0I59GRrSbC/structure.png?h=300&w=458 "Bicyclo[5.3.0]dec-1(7)-ene-2,5-dione")
| SpectraBase Compound ID | 8usWJZSG8BF |
|---|---|
| InChI | InChI=1S/C10H12O2/c11-8-4-5-10(12)9-3-1-2-7(9)6-8/h1-6H2 |
| InChIKey | KWZDQDBPTAVFLB-UHFFFAOYSA-N |
| Mol Weight | 164.2 g/mol |
| Molecular Formula | C10H12O2 |
| Exact Mass | 164.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | K0I59GRrSbC |
|---|---|
| Name | Bicyclo[5.3.0]dec-1(7)-ene-2,5-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.083729624 u |
| Formula | C10H12O2 |
| InChI | InChI=1S/C10H12O2/c11-8-4-5-10(12)9-3-1-2-7(9)6-8/h1-6H2 |
| InChIKey | KWZDQDBPTAVFLB-UHFFFAOYSA-N |
| Molecular Weight | 164.204 g/mol |
| SMILES | C1(=O)C=2CCCC2CC(CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944095 |