![Bicyclo[3.2.2]nona-6,8-dien-3-one](/api/spectrum/BHPV3VnAXFd/structure.png?h=300&w=458 "Bicyclo[3.2.2]nona-6,8-dien-3-one")
| SpectraBase Compound ID | JguWl8zHr0B |
|---|---|
| InChI | InChI=1S/C9H10O/c10-9-5-7-1-2-8(6-9)4-3-7/h1-4,7-8H,5-6H2/t7-,8+ |
| InChIKey | DCXPALZMGVJLEB-OCAPTIKFSA-N |
| Mol Weight | 134.18 g/mol |
| Molecular Formula | C9H10O |
| Exact Mass | 134.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BHPV3VnAXFd |
|---|---|
| Name | Bicyclo[3.2.2]nona-6,8-dien-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 134.073164941 u |
| Formula | C9H10O |
| InChI | InChI=1S/C9H10O/c10-9-5-7-1-2-8(6-9)4-3-7/h1-4,7-8H,5-6H2/t7-,8+ |
| InChIKey | DCXPALZMGVJLEB-OCAPTIKFSA-N |
| Molecular Weight | 134.178 g/mol |
| SMILES | C1=C[C@]2(CC(C[C@@]1(C=C2)[H])=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.982817 |