| SpectraBase Compound ID | Ae4FghtWMS2 |
|---|---|
| InChI | InChI=1S/C21H44O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h21-22H,3-20H2,1-2H3 |
| InChIKey | ZWKMKPIPURRGEC-UHFFFAOYSA-N |
| Mol Weight | 312.6 g/mol |
| Molecular Formula | C21H44O |
| Exact Mass | 312.339216 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KhiZ714fp6n |
|---|---|
| Name | Henicosan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.339216036 u |
| Formula | C21H44O |
| InChI | InChI=1S/C21H44O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h21-22H,3-20H2,1-2H3 |
| InChIKey | ZWKMKPIPURRGEC-UHFFFAOYSA-N |
| Molecular Weight | 312.582 g/mol |
| SMILES | C(O)(CCCCCCCCCCCCCCCCCCC)C |