| SpectraBase Compound ID | FlgY90wECMg |
|---|---|
| InChI | InChI=1S/C16H30Br2O2/c1-3-15(17)16(18)12-10-8-6-4-5-7-9-11-13-20-14(2)19/h15-16H,3-13H2,1-2H3 |
| InChIKey | XMAZKRBRCLXYIJ-UHFFFAOYSA-N |
| Mol Weight | 414.22 g/mol |
| Molecular Formula | C16H30Br2O2 |
| Exact Mass | 412.061256 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CYpAMduCVQM |
|---|---|
| Name | 11,12-Dibromo-tetradecan-1-ol acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 412.061256204 u |
| Formula | C16H30Br2O2 |
| InChI | InChI=1S/C16H30Br2O2/c1-3-15(17)16(18)12-10-8-6-4-5-7-9-11-13-20-14(2)19/h15-16H,3-13H2,1-2H3 |
| InChIKey | XMAZKRBRCLXYIJ-UHFFFAOYSA-N |
| Molecular Weight | 414.222 g/mol |
| SMILES | C(CCCCCCOC(C)=O)CCCC(C(CC)Br)Br |