![Spiro[4.7]dodecane](/api/spectrum/AlorGRDOEP5/structure.png?h=300&w=458 "Spiro[4.7]dodecane")
| SpectraBase Compound ID | 7xu1WpA7x4X |
|---|---|
| InChI | InChI=1S/C12H22/c1-2-4-8-12(9-5-3-1)10-6-7-11-12/h1-11H2 |
| InChIKey | WNHBZUBVGXTMEL-UHFFFAOYSA-N |
| Mol Weight | 166.31 g/mol |
| Molecular Formula | C12H22 |
| Exact Mass | 166.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AlorGRDOEP5 |
|---|---|
| Name | Spiro[4.7]dodecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.172150708 u |
| Formula | C12H22 |
| InChI | InChI=1S/C12H22/c1-2-4-8-12(9-5-3-1)10-6-7-11-12/h1-11H2 |
| InChIKey | WNHBZUBVGXTMEL-UHFFFAOYSA-N |
| Molecular Weight | 166.308 g/mol |
| SMILES | C12(CCCC2)CCCCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97285 |