| SpectraBase Compound ID | 8AA4ZKGXBbS |
|---|---|
| InChI | InChI=1S/C16H22O/c1-13-7-5-6-10-15(13)16(17)12-11-14-8-3-2-4-9-14/h2-4,8-9,15-17H,1,5-7,10-12H2 |
| InChIKey | BWXDSSOBCYORGN-UHFFFAOYSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C16H22O |
| Exact Mass | 230.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EyvWvEk5dwR |
|---|---|
| Name | 1-(2-Methylenecyclohexyl)-3-phenylpropan-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.167065327 u |
| Formula | C16H22O |
| InChI | InChI=1S/C16H22O/c1-13-7-5-6-10-15(13)16(17)12-11-14-8-3-2-4-9-14/h2-4,8-9,15-17H,1,5-7,10-12H2 |
| InChIKey | BWXDSSOBCYORGN-UHFFFAOYSA-N |
| Molecular Weight | 230.351 g/mol |
| SMILES | C1=CC=CC(=C1)CCC(C1C(=C)CCCC1)O |