| SpectraBase Compound ID | D0GsT3LI6Mo |
|---|---|
| InChI | InChI=1S/C14H22O/c1-3-5-10-13(9-4-2)15-14-11-7-6-8-12-14/h6-8,11-13H,3-5,9-10H2,1-2H3 |
| InChIKey | CAILIGCGLLCWFJ-UHFFFAOYSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CkvNMJbNrt7 |
|---|---|
| Name | Octane, 4-phenoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.167065327 u |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-3-5-10-13(9-4-2)15-14-11-7-6-8-12-14/h6-8,11-13H,3-5,9-10H2,1-2H3 |
| InChIKey | CAILIGCGLLCWFJ-UHFFFAOYSA-N |
| Molecular Weight | 206.329 g/mol |
| SMILES | CCCC(CCCC)OC=1C=CC=CC1 |