| SpectraBase Compound ID | 8GkrBItEfSW |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-4-6-8-13(5-2)11-16-10-7-9-14-12(3)15/h13H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | JROXMRVYNAHIMS-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 | 4Q2mfMq5Dx9 |
|---|---|
| Name | 3-(2-Ethylhexoxy)propan-1-amine, N-acetate |
| 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/c1-4-6-8-13(5-2)11-16-10-7-9-14-12(3)15/h13H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | JROXMRVYNAHIMS-UHFFFAOYSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | CCCCC(COCCCNC(=O)C)CC |