| SpectraBase Compound ID | AkEBOnzSB4q |
|---|---|
| InChI | InChI=1S/C21H43NO2/c1-5-6-7-8-9-10-11-12-13-14-17-20(22(2)3)18-15-16-19-21(23)24-4/h20H,5-19H2,1-4H3 |
| InChIKey | CNGMNWBLDZNKRT-UHFFFAOYSA-N |
| Mol Weight | 341.6 g/mol |
| Molecular Formula | C21H43NO2 |
| Exact Mass | 341.32938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cz74EfTgdy4 |
|---|---|
| Name | Octadecanoic acid, 6-(dimethylamino)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.329379627 u |
| Formula | C21H43NO2 |
| InChI | InChI=1S/C21H43NO2/c1-5-6-7-8-9-10-11-12-13-14-17-20(22(2)3)18-15-16-19-21(23)24-4/h20H,5-19H2,1-4H3 |
| InChIKey | CNGMNWBLDZNKRT-UHFFFAOYSA-N |
| Molecular Weight | 341.580 g/mol |
| SMILES | C(C(CCCCCCCCCCCC)N(C)C)CCCC(OC)=O |