| SpectraBase Compound ID | 1Nf7HTBJs6y |
|---|---|
| InChI | InChI=1S/C16H31BrO2/c1-3-5-6-7-8-9-10-11-13-15(12-4-2)19-16(18)14-17/h15H,3-14H2,1-2H3 |
| InChIKey | MPLZIIUQQILFRZ-UHFFFAOYSA-N |
| Mol Weight | 335.33 g/mol |
| Molecular Formula | C16H31BrO2 |
| Exact Mass | 334.150743 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KuWQPhbPNNo |
|---|---|
| Name | Bromoacetic acid, 4-tetradecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.150743236 u |
| Formula | C16H31BrO2 |
| InChI | InChI=1S/C16H31BrO2/c1-3-5-6-7-8-9-10-11-13-15(12-4-2)19-16(18)14-17/h15H,3-14H2,1-2H3 |
| InChIKey | MPLZIIUQQILFRZ-UHFFFAOYSA-N |
| Molecular Weight | 335.326 g/mol |
| SMILES | C(Br)C(=O)OC(CCCCCCCCCC)CCC |