| SpectraBase Compound ID | 4wpfycpMfN8 |
|---|---|
| InChI | InChI=1S/C15H23NO2/c1-3-4-6-9-13(2)16-15(17)18-12-14-10-7-5-8-11-14/h5,7-8,10-11,13H,3-4,6,9,12H2,1-2H3,(H,16,17) |
| InChIKey | JNKYJUQPPMUBPM-UHFFFAOYSA-N |
| Mol Weight | 249.35 g/mol |
| Molecular Formula | C15H23NO2 |
| Exact Mass | 249.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IArXZOdwaC |
|---|---|
| Name | Carbonic acid, monoamide, N-hept-2-yl-, benzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.172878983 u |
| Formula | C15H23NO2 |
| InChI | InChI=1S/C15H23NO2/c1-3-4-6-9-13(2)16-15(17)18-12-14-10-7-5-8-11-14/h5,7-8,10-11,13H,3-4,6,9,12H2,1-2H3,(H,16,17) |
| InChIKey | JNKYJUQPPMUBPM-UHFFFAOYSA-N |
| Molecular Weight | 249.354 g/mol |
| SMILES | C(OCC=1C=CC=CC1)(=O)NC(CCCCC)C |