| SpectraBase Compound ID | 6J4bPCyO0tR |
|---|---|
| InChI | InChI=1S/C27H54O2/c1-4-6-8-10-12-13-14-15-16-17-19-21-23-25-27(28)29-26(3)24-22-20-18-11-9-7-5-2/h26H,4-25H2,1-3H3 |
| InChIKey | VGTOVSOELJWYCV-UHFFFAOYSA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C27H54O2 |
| Exact Mass | 410.412381 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47Sxq2dp8dj |
|---|---|
| Name | 2-Undecanol palmitate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.412380977 u |
| Formula | C27H54O2 |
| InChI | InChI=1S/C27H54O2/c1-4-6-8-10-12-13-14-15-16-17-19-21-23-25-27(28)29-26(3)24-22-20-18-11-9-7-5-2/h26H,4-25H2,1-3H3 |
| InChIKey | VGTOVSOELJWYCV-UHFFFAOYSA-N |
| Molecular Weight | 410.727 g/mol |
| SMILES | C(CCCCCCCCCCCCCCC)(=O)OC(CCCCCCCCC)C |