| SpectraBase Compound ID | IOWGhZZW9TW |
|---|---|
| InChI | InChI=1S/C12H22O/c1-3-12(13,4-2)10-11-8-6-5-7-9-11/h10,13H,3-9H2,1-2H3 |
| InChIKey | OYCVTUHFXWYPLY-UHFFFAOYSA-N |
| Mol Weight | 182.31 g/mol |
| Molecular Formula | C12H22O |
| Exact Mass | 182.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3MhpPbTEDLz |
|---|---|
| Name | 3-(Cyclohexylenemethyl)-3-pentanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.167065327 u |
| Formula | C12H22O |
| InChI | InChI=1S/C12H22O/c1-3-12(13,4-2)10-11-8-6-5-7-9-11/h10,13H,3-9H2,1-2H3 |
| InChIKey | OYCVTUHFXWYPLY-UHFFFAOYSA-N |
| Molecular Weight | 182.307 g/mol |
| SMILES | C(=C1CCCCC1)C(O)(CC)CC |