| SpectraBase Compound ID | 2ecjsgcnmB3 |
|---|---|
| InChI | InChI=1S/C16H33NO2/c1-4-5-6-7-8-11-14-17(2,3)15-12-9-10-13-16(18)19/h4-15H2,1-3H3 |
| InChIKey | BSSXWZUUBPDUJO-UHFFFAOYSA-N |
| Mol Weight | 271.4 g/mol |
| Molecular Formula | C16H33NO2 |
| Exact Mass | 271.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3tZ7ixqBtCG |
|---|---|
| Name | (5-Carboxypentyl)dimethyloctylammonium hydroxide, inner salt |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.251129305 u |
| Formula | C16H33NO2 |
| InChI | InChI=1S/C16H33NO2/c1-4-5-6-7-8-11-14-17(2,3)15-12-9-10-13-16(18)19/h4-15H2,1-3H3 |
| InChIKey | BSSXWZUUBPDUJO-UHFFFAOYSA-N |
| SMILES | CCCCCCCC[N+](CCCCCC([O-])=O)(C)C |