| SpectraBase Compound ID | 4qjlQ4eN7rX |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-4-5-6-7-8-9-10-14-13(15)16-11-12(2)3/h12H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | MFVJOFVEEHZBIE-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 | 6TtOTFT9Bi7 |
|---|---|
| Name | Carbonic acid, monoamide, N-octyl-, isobutyl 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/c1-4-5-6-7-8-9-10-14-13(15)16-11-12(2)3/h12H,4-11H2,1-3H3,(H,14,15) |
| InChIKey | MFVJOFVEEHZBIE-UHFFFAOYSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | C(CCNC(OCC(C)C)=O)CCCCC |