| SpectraBase Compound ID | 9VaM6b52zNA |
|---|---|
| InChI | InChI=1S/C13H28O/c1-4-7-8-9-10-11-12-13(14,5-2)6-3/h14H,4-12H2,1-3H3 |
| InChIKey | QXBICICNPXFSCC-UHFFFAOYSA-N |
| Mol Weight | 200.37 g/mol |
| Molecular Formula | C13H28O |
| Exact Mass | 200.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BebxCCKryne |
|---|---|
| Name | 3-Undecanol, 3-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.214015521 u |
| Formula | C13H28O |
| InChI | InChI=1S/C13H28O/c1-4-7-8-9-10-11-12-13(14,5-2)6-3/h14H,4-12H2,1-3H3 |
| InChIKey | QXBICICNPXFSCC-UHFFFAOYSA-N |
| Molecular Weight | 200.366 g/mol |
| SMILES | CCC(CC)(O)CCCCCCCC |