| SpectraBase Compound ID | 3Fsh7WN7r4v |
|---|---|
| InChI | InChI=1S/C11H18O2/c1-11(2,3)7-9-13-10-6-4-5-8-12-10/h10H,4-6,8H2,1-3H3 |
| InChIKey | SFTJUAZJZZHAOZ-UHFFFAOYSA-N |
| Mol Weight | 182.26 g/mol |
| Molecular Formula | C11H18O2 |
| Exact Mass | 182.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AC97XVf268r |
|---|---|
| Name | 3,3-Dimethyl-1-(tetrahydropyran-2-yl)oxy-1-butyne |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.130679818 u |
| Formula | C11H18O2 |
| InChI | InChI=1S/C11H18O2/c1-11(2,3)7-9-13-10-6-4-5-8-12-10/h10H,4-6,8H2,1-3H3 |
| InChIKey | SFTJUAZJZZHAOZ-UHFFFAOYSA-N |
| Molecular Weight | 182.263 g/mol |
| SMILES | C(#CC(C)(C)C)OC1OCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.824575 |