| SpectraBase Compound ID | LAG6oueNsEq |
|---|---|
| InChI | InChI=1S/C17H27NO2/c1-3-5-6-10-14-18(13-4-2)17(19)20-15-16-11-8-7-9-12-16/h7-9,11-12H,3-6,10,13-15H2,1-2H3 |
| InChIKey | KQLSLIKGIHUREC-UHFFFAOYSA-N |
| Mol Weight | 277.41 g/mol |
| Molecular Formula | C17H27NO2 |
| Exact Mass | 277.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ej0sU0Lf46B |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-hexyl-, benzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.204179111 u |
| Formula | C17H27NO2 |
| InChI | InChI=1S/C17H27NO2/c1-3-5-6-10-14-18(13-4-2)17(19)20-15-16-11-8-7-9-12-16/h7-9,11-12H,3-6,10,13-15H2,1-2H3 |
| InChIKey | KQLSLIKGIHUREC-UHFFFAOYSA-N |
| Molecular Weight | 277.408 g/mol |
| SMILES | C(N(CCC)CCCCCC)(=O)OCC=1C=CC=CC1 |