| SpectraBase Compound ID | GN0hVQQJ6H8 |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-5-7-8-12(6-2)10-16-13(15)14-9-11(3)4/h11-12H,5-10H2,1-4H3,(H,14,15) |
| InChIKey | VVDGCTGRBHFZRJ-UHFFFAOYSA-N |
| Mol Weight | 229.36 g/mol |
| Molecular Formula | C13H27NO2 |
| Exact Mass | 229.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iaxq4cbQj8e |
|---|---|
| Name | Carbonic acid, monoamide, N-isobutyl-, 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.204179111 u |
| Formula | C13H27NO2 |
| InChI | InChI=1S/C13H27NO2/c1-5-7-8-12(6-2)10-16-13(15)14-9-11(3)4/h11-12H,5-10H2,1-4H3,(H,14,15) |
| InChIKey | VVDGCTGRBHFZRJ-UHFFFAOYSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | C(NCC(C)C)(=O)OCC(CCCC)CC |