| SpectraBase Compound ID | 1ego8CEFwj4 |
|---|---|
| InChI | InChI=1S/C12H23NO4/c1-4-5-6-13(7-9-16-11(2)14)8-10-17-12(3)15/h4-10H2,1-3H3 |
| InChIKey | KCCKHTSQHNFTPN-UHFFFAOYSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C12H23NO4 |
| Exact Mass | 245.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3wDJSmINDqB |
|---|---|
| Name | N-Butyldiethanolamine, diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.162708221 u |
| Formula | C12H23NO4 |
| InChI | InChI=1S/C12H23NO4/c1-4-5-6-13(7-9-16-11(2)14)8-10-17-12(3)15/h4-10H2,1-3H3 |
| InChIKey | KCCKHTSQHNFTPN-UHFFFAOYSA-N |
| Molecular Weight | 245.319 g/mol |
| SMILES | C(OC(C)=O)CN(CCOC(C)=O)CCCC |