| SpectraBase Compound ID | JdstepoF97M |
|---|---|
| InChI | InChI=1S/C12H22/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h11-12H,1-10H2 |
| InChIKey | YIYWTNBPUYHPLR-UHFFFAOYSA-N |
| Mol Weight | 166.31 g/mol |
| Molecular Formula | C12H22 |
| Exact Mass | 166.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F90FdkeL718 |
|---|---|
| Name | Cyclohexane, (cyclopentylmethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.172150708 u |
| Formula | C12H22 |
| InChI | InChI=1S/C12H22/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h11-12H,1-10H2 |
| InChIKey | YIYWTNBPUYHPLR-UHFFFAOYSA-N |
| Molecular Weight | 166.308 g/mol |
| SMILES | C(C1CCCCC1)C1CCCC1 |