| SpectraBase Compound ID | 5jFV5t2xpy5 |
|---|---|
| InChI | InChI=1S/C15H16O/c1-16-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13/h5,9-12H,2-4,6H2,1H3 |
| InChIKey | RRNAAUGFOMJXNJ-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C15H16O |
| Exact Mass | 212.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lcs4KpqsOaG |
|---|---|
| Name | 1-(Cyclohex-1-en-1-ylethynyl)-4-methoxybenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.120115134 u |
| Formula | C15H16O |
| InChI | InChI=1S/C15H16O/c1-16-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13/h5,9-12H,2-4,6H2,1H3 |
| InChIKey | RRNAAUGFOMJXNJ-UHFFFAOYSA-N |
| Molecular Weight | 212.292 g/mol |
| SMILES | C=1C=C(C#CC=2CCCCC2)C=CC1OC |