| SpectraBase Compound ID | OF7YMAlxDS |
|---|---|
| InChI | InChI=1S/C16H26/c1-5-6-7-8-9-14-10-12-15(13-11-14)16(2,3)4/h10,15H,5-7,11-13H2,1-4H3 |
| InChIKey | SILSQQPCNZXSGT-UHFFFAOYSA-N |
| Mol Weight | 218.38 g/mol |
| Molecular Formula | C16H26 |
| Exact Mass | 218.203451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GPpTFilmXx8 |
|---|---|
| Name | 1-4'-T-Butylcyclohex-1'-enyl)hex-1-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.203450837 u |
| Formula | C16H26 |
| InChI | InChI=1S/C16H26/c1-5-6-7-8-9-14-10-12-15(13-11-14)16(2,3)4/h10,15H,5-7,11-13H2,1-4H3 |
| InChIKey | SILSQQPCNZXSGT-UHFFFAOYSA-N |
| Molecular Weight | 218.384 g/mol |
| SMILES | C(#CCCCC)C1=CCC(C(C)(C)C)CC1 |