| SpectraBase Compound ID | LQa9JP8E2aS |
|---|---|
| InChI | InChI=1S/C26H50O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-26(27)24-19-22-25-20-17-18-21-25/h25H,2-24H2,1H3 |
| InChIKey | MEDPYMMZEVIBCH-UHFFFAOYSA-N |
| Mol Weight | 378.7 g/mol |
| Molecular Formula | C26H50O |
| Exact Mass | 378.386166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6XGmJclGB76 |
|---|---|
| Name | 4-Heneicosanone, 1-cyclopentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.386166229 u |
| Formula | C26H50O |
| InChI | InChI=1S/C26H50O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-26(27)24-19-22-25-20-17-18-21-25/h25H,2-24H2,1H3 |
| InChIKey | MEDPYMMZEVIBCH-UHFFFAOYSA-N |
| Molecular Weight | 378.685 g/mol |
| SMILES | C(CC1CCCC1)CC(CCCCCCCCCCCCCCCCC)=O |