| SpectraBase Compound ID | CQLQ9t9ZWy5 |
|---|---|
| InChI | InChI=1S/C10H20O/c1-10(2,11)9-7-5-3-4-6-8-9/h9,11H,3-8H2,1-2H3 |
| InChIKey | LFNOSERJRPEZBS-UHFFFAOYSA-N |
| Mol Weight | 156.27 g/mol |
| Molecular Formula | C10H20O |
| Exact Mass | 156.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GCpXP78ov2n |
|---|---|
| Name | Cycloheptanemethanol, .alpha.,.alpha.-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.151415263 u |
| Formula | C10H20O |
| InChI | InChI=1S/C10H20O/c1-10(2,11)9-7-5-3-4-6-8-9/h9,11H,3-8H2,1-2H3 |
| InChIKey | LFNOSERJRPEZBS-UHFFFAOYSA-N |
| Molecular Weight | 156.269 g/mol |
| SMILES | C(C)(C)(O)C1CCCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898785 |