| SpectraBase Compound ID | FiQFH3B6NO0 |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-2-3-9-14(15)10-11-16-12-13-7-5-4-6-8-13/h1,4-8,14-15H,3,9-12H2/t14-/m1/s1 |
| InChIKey | HBRXQOSBPQZONM-CQSZACIVSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JV0kt0CsoXk |
|---|---|
| Name | (3R)-1-(Benzyloxy)-hept-6-yn-3-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.130679818 u |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-2-3-9-14(15)10-11-16-12-13-7-5-4-6-8-13/h1,4-8,14-15H,3,9-12H2/t14-/m1/s1 |
| InChIKey | HBRXQOSBPQZONM-CQSZACIVSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(C[C@@](CCC#C)(O)[H])OCC=1C=CC=CC1 |