| SpectraBase Compound ID | 4lrYRpXpzcp |
|---|---|
| InChI | InChI=1S/C12H23NO5/c1-2-18-12(14)11-13-3-5-15-7-9-17-10-8-16-6-4-13/h2-11H2,1H3 |
| InChIKey | LJFCHCXEWUKYOZ-UHFFFAOYSA-N |
| Mol Weight | 261.32 g/mol |
| Molecular Formula | C12H23NO5 |
| Exact Mass | 261.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNMl2mePuHC |
|---|---|
| Name | 2-(1,4,7-Trioxa-10-azacyclododec-10-yl)acetic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.157622840 u |
| Formula | C12H23NO5 |
| InChI | InChI=1S/C12H23NO5/c1-2-18-12(14)11-13-3-5-15-7-9-17-10-8-16-6-4-13/h2-11H2,1H3 |
| InChIKey | LJFCHCXEWUKYOZ-UHFFFAOYSA-N |
| Molecular Weight | 261.318 g/mol |
| SMILES | C(N1CCOCCOCCOCC1)C(=O)OCC |