| SpectraBase Compound ID | BrjItWZpJ6Q |
|---|---|
| InChI | InChI=1S/C17H27NO2/c1-4-6-8-11-15(3)18(17(19)20-5-2)14-16-12-9-7-10-13-16/h7,9-10,12-13,15H,4-6,8,11,14H2,1-3H3 |
| InChIKey | XWOCMWCHQKRCKX-UHFFFAOYSA-N |
| Mol Weight | 277.41 g/mol |
| Molecular Formula | C17H27NO2 |
| Exact Mass | 277.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KV7cT7LAnlf |
|---|---|
| Name | Carbonic acid, monoamide, N-benzyl-N-(hept-2-yl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.204179111 u |
| Formula | C17H27NO2 |
| InChI | InChI=1S/C17H27NO2/c1-4-6-8-11-15(3)18(17(19)20-5-2)14-16-12-9-7-10-13-16/h7,9-10,12-13,15H,4-6,8,11,14H2,1-3H3 |
| InChIKey | XWOCMWCHQKRCKX-UHFFFAOYSA-N |
| Molecular Weight | 277.408 g/mol |
| SMILES | C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)OCC |