| SpectraBase Compound ID | CKtMVKh9Vdg |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-3-5-7-11(13)9-8-10(12)6-4-2/h3-9H2,1-2H3 |
| InChIKey | CEVSURAVVGKQNE-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7aA1c8NsXsp |
|---|---|
| Name | 4,7-Undecadione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-3-5-7-11(13)9-8-10(12)6-4-2/h3-9H2,1-2H3 |
| InChIKey | CEVSURAVVGKQNE-UHFFFAOYSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | C(=O)(CCC(=O)CCCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940639 |