| SpectraBase Compound ID | H2QieJ3z2oH |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-5-8-9-12(7-3)11-14(10-6-2)13(15)16-4/h12H,5-11H2,1-4H3 |
| InChIKey | AKLAZPWZFUWKGT-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 | AB8gAYdUdTZ |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-(2-ethylhexyl)-, methyl 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/c1-5-8-9-12(7-3)11-14(10-6-2)13(15)16-4/h12H,5-11H2,1-4H3 |
| InChIKey | AKLAZPWZFUWKGT-UHFFFAOYSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | C(N(CCC)CC(CCCC)CC)(=O)OC |