| SpectraBase Compound ID | HAoZwCgYnc7 |
|---|---|
| InChI | InChI=1S/C16H16O2/c1-2-15(17)14-8-4-3-7-13(14)9-12-16(18)10-5-6-11-16/h1,3-4,7-8,15,17-18H,5-6,10-11H2 |
| InChIKey | JIRIBDIMNGWLAB-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C16H16O2 |
| Exact Mass | 240.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JZeDqzsPHZt |
|---|---|
| Name | 1-((2-(1-Hydroxyprop-2-yn-1-yl)phenyl)ethynyl)cyclopentanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.115029753 u |
| Formula | C16H16O2 |
| InChI | InChI=1S/C16H16O2/c1-2-15(17)14-8-4-3-7-13(14)9-12-16(18)10-5-6-11-16/h1,3-4,7-8,15,17-18H,5-6,10-11H2 |
| InChIKey | JIRIBDIMNGWLAB-UHFFFAOYSA-N |
| Molecular Weight | 240.302 g/mol |
| SMILES | C1(CCCC1)(O)C#CC=1C(=CC=CC1)C(C#C)O |